N-[2-(aminomethyl)phenyl]-3-hydroxy-4-methylbenzamide

C15H16N2O2 — CID 16772682

IUPACN-[2-(aminomethyl)phenyl]-3-hydroxy-4-methylbenzamide
SMILESCc1ccc(C(=O)Nc2ccccc2CN)cc1O
InChIInChI=1S/C15H16N2O2/c1-10-6-7-11(8-14(10)18)15(19)17-13-5-3-2-4-12(13)9-16/h2-8,18H,9,16H2,1H3,(H,17,19)
InChIKeyMQUKJJPEZQXPMU-UHFFFAOYSA-N
MW256.31 g/mol
LogP2.41
Rot. Bonds3

About N-[2-(aminomethyl)phenyl]-3-hydroxy-4-methylbenzamide

N-[2-(aminomethyl)phenyl]-3-hydroxy-4-methylbenzamide (PubChem CID 16772682) has the molecular formula C15H16N2O2 and a molecular weight of 256.31 g/mol. Its IUPAC name is N-[2-(aminomethyl)phenyl]-3-hydroxy-4-methylbenzamide.

Molecular Properties

Compound NameN-[2-(aminomethyl)phenyl]-3-hydroxy-4-methylbenzamide
PubChem CID16772682
Molecular FormulaC15H16N2O2
Molecular Weight256.31 g/mol
Exact Mass256.12
IUPAC NameN-[2-(aminomethyl)phenyl]-3-hydroxy-4-methylbenzamide
SMILESCc1ccc(C(=O)Nc2ccccc2CN)cc1O
InChIInChI=1S/C15H16N2O2/c1-10-6-7-11(8-14(10)18)15(19)17-13-5-3-2-4-12(13)9-16/h2-8,18H,9,16H2,1H3,(H,17,19)
InChIKeyMQUKJJPEZQXPMU-UHFFFAOYSA-N
XLogP2.41
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.31
LogP ≤ 52.41
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

3-hydroxy-4-methyl-N-[2-(methylaminomethyl)phenyl]benzamide
CID 43600945
3-hydroxy-N-(2-iodophenyl)-4-methylbenzamide
CID 28881825
N-[5-(aminomethyl)-2-methylphenyl]-3-hydroxy-4-methylbenzamide
CID 62105051
N-[2-(aminomethyl)phenyl]-3,5-dihydroxybenzamide
CID 107705031
N-[2-[(4-tert-butylbenzoyl)amino]phenyl]-3-hydroxy-4-methylbenzamide
CID 21352752
3-hydroxy-4-methyl-N-(2-methylsulfanylphenyl)benzamide
CID 103955489
N-[2-(aminomethyl)phenyl]-2,4-dimethylbenzamide
CID 16772806
3-fluoro-N-[2-(hydroxymethyl)phenyl]-4-methylbenzamide
CID 60682262
4-hydroxy-3-methyl-N-(2-propylphenyl)benzamide
CID 103956497
N-[2-(aminomethyl)phenyl]-4-bromo-2-methylbenzamide
CID 64882517
N-[2-(aminomethyl)phenyl]quinoxaline-6-carboxamide
CID 63754296
N-[2-(aminomethyl)phenyl]-4-bromo-3-chlorobenzamide
CID 81295178

Frequently Asked Questions

What is the IUPAC name of N-[2-(aminomethyl)phenyl]-3-hydroxy-4-methylbenzamide?
The IUPAC name of N-[2-(aminomethyl)phenyl]-3-hydroxy-4-methylbenzamide (CID 16772682) is N-[2-(aminomethyl)phenyl]-3-hydroxy-4-methylbenzamide.
What is the SMILES notation for N-[2-(aminomethyl)phenyl]-3-hydroxy-4-methylbenzamide?
The canonical SMILES for N-[2-(aminomethyl)phenyl]-3-hydroxy-4-methylbenzamide is Cc1ccc(C(=O)Nc2ccccc2CN)cc1O.
What is the InChIKey of N-[2-(aminomethyl)phenyl]-3-hydroxy-4-methylbenzamide?
The InChIKey is MQUKJJPEZQXPMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O2/c1-10-6-7-11(8-14(10)18)15(19)17-13-5-3-2-4-12(13)9-16/h2-8,18H,9,16H2,1H3,(H,17,19).
What are the key properties of N-[2-(aminomethyl)phenyl]-3-hydroxy-4-methylbenzamide?
N-[2-(aminomethyl)phenyl]-3-hydroxy-4-methylbenzamide has a molecular weight of 256.31 g/mol, XLogP of 2.41, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(aminomethyl)phenyl]-3-hydroxy-4-methylbenzamide is sourced from PubChem (CID 16772682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).