Drug Information
General Information of This Drug
| Drug ID | DRG00321 | |||||
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| Drug Name | 3-Benzyloxyaniline | |||||
| Synonyms |
3-Benzyloxyaniline; 1484-26-0; 3-(benzyloxy)aniline; Benzenamine, 3-(phenylmethoxy)-; 3-phenylmethoxyaniline; 3-(benzyloxy)benzenamine; 3-[(phenylmethyl)oxy]aniline; 3-Benzyloxy-phenylamine; MFCD00007784; 3-Aminophenyl benzyl ether; IAB1VDA972; CHEMBL1642680; EINECS 216-056-6; Aniline, m-(benzyloxy)-; UNII-IAB1VDA972; 3-(phenylmethoxy)phenylamine; AI3-52570; 3-benyloxyaniline; m-benzyloxy-aniline; O1D; 3-benzyloxy aniline; 3-benzyloxyphenylamine; 3-Benzyloxyaniline, 98%; M-(BENZYLOXY)ANILINE; NCIOpen2_004385; SCHEMBL291445; (3-phenylmethyloxyphenyl)amine; (3-phenylmethoxy-phenyl)-amine; 3-(BENZYLOXY)PHENYLAMINE; DTXSID9022156; M-AMINOPHENYL BENZYL ETHER; HMS3741I11; BCP21762; BDBM50334273; STL067389; AKOS000132828; CS-W002033; PS-6048; NCGC00325909-01; BP-10087; SY007822; DB-003369; A3250; AM20060409; B4197; FT-0633599; NS00024858; EN300-52995; AB00375952-03; W-108103; Q27280632; F3377-0293; Z239127534
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| Structure |
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| Formula |
C13H13NO
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| #Ro5 Violations (Lipinski): 0 | Molecular Weight (mw) | 199.25 | ||||
| Lipid-water partition coefficient (xlogp) | 3.1 | |||||
| Hydrogen Bond Donor Count (hbonddonor) | 1 | |||||
| Hydrogen Bond Acceptor Count (hbondacc) | 2 | |||||
| Rotatable Bond Count (rotbonds) | 3 | |||||
| PubChem CID | ||||||
| Canonical smiles |
C1=CC=C(C=C1)COC2=CC=CC(=C2)N
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| InChI |
InChI=1S/C13H13NO/c14-12-7-4-8-13(9-12)15-10-11-5-2-1-3-6-11/h1-9H,10,14H2
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| InChIKey |
IGPFOKFDBICQMC-UHFFFAOYSA-N
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| IUPAC Name |
3-phenylmethoxyaniline
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