N-(3-amino-4-methylphenyl)-3-hydroxy-4-methoxybenzamide

C15H16N2O3 — CID 79726156

IUPACN-(3-amino-4-methylphenyl)-3-hydroxy-4-methoxybenzamide
SMILESCOc1ccc(C(=O)Nc2ccc(C)c(N)c2)cc1O
InChIInChI=1S/C15H16N2O3/c1-9-3-5-11(8-12(9)16)17-15(19)10-4-6-14(20-2)13(18)7-10/h3-8,18H,16H2,1-2H3,(H,17,19)
InChIKeyGIWZGJFMNFBAEI-UHFFFAOYSA-N
MW272.30 g/mol
LogP2.54
Rot. Bonds3

About N-(3-amino-4-methylphenyl)-3-hydroxy-4-methoxybenzamide

N-(3-amino-4-methylphenyl)-3-hydroxy-4-methoxybenzamide (PubChem CID 79726156) has the molecular formula C15H16N2O3 and a molecular weight of 272.30 g/mol. Its IUPAC name is N-(3-amino-4-methylphenyl)-3-hydroxy-4-methoxybenzamide.

Molecular Properties

Compound NameN-(3-amino-4-methylphenyl)-3-hydroxy-4-methoxybenzamide
PubChem CID79726156
Molecular FormulaC15H16N2O3
Molecular Weight272.30 g/mol
Exact Mass272.12
IUPAC NameN-(3-amino-4-methylphenyl)-3-hydroxy-4-methoxybenzamide
SMILESCOc1ccc(C(=O)Nc2ccc(C)c(N)c2)cc1O
InChIInChI=1S/C15H16N2O3/c1-9-3-5-11(8-12(9)16)17-15(19)10-4-6-14(20-2)13(18)7-10/h3-8,18H,16H2,1-2H3,(H,17,19)
InChIKeyGIWZGJFMNFBAEI-UHFFFAOYSA-N
XLogP2.54
TPSA84.58 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.30
LogP ≤ 52.54
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

N-(3-amino-4-methylphenyl)-3,4-dimethoxybenzamide
CID 22732292
4-amino-N-(3-hydroxy-4-methoxyphenyl)benzamide
CID 43710822
4-amino-3-fluoro-N-(3-hydroxy-4-methoxyphenyl)benzamide
CID 63188030
N-(3-amino-2,6-dimethylphenyl)-3-hydroxy-4-methoxybenzamide
CID 79737127
N-(3-aminophenyl)-3-hydroxy-4-methoxybenzamide
CID 79726483
N-(3,5-dimethylphenyl)-3-hydroxy-4-methoxybenzamide
CID 79600826
3-amino-4-methyl-N-(3,4,5-trimethoxyphenyl)benzamide
CID 28723700
N-(3-amino-4-methylphenyl)-3,5-dimethoxybenzamide
CID 24709261
N-(3-amino-4-methoxyphenyl)-4-hydroxybenzamide
CID 43599919
4-amino-N-(3-fluoro-4-methoxyphenyl)-3-hydroxybenzamide
CID 107074051
3-amino-N-(3,4-dimethylphenyl)-4-hydroxybenzamide
CID 66965766
1-N,3-N-bis(3-amino-4-methylphenyl)-5-hydroxybenzene-1,3-dicarboxamide
CID 139753115

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-4-methylphenyl)-3-hydroxy-4-methoxybenzamide?
The IUPAC name of N-(3-amino-4-methylphenyl)-3-hydroxy-4-methoxybenzamide (CID 79726156) is N-(3-amino-4-methylphenyl)-3-hydroxy-4-methoxybenzamide.
What is the SMILES notation for N-(3-amino-4-methylphenyl)-3-hydroxy-4-methoxybenzamide?
The canonical SMILES for N-(3-amino-4-methylphenyl)-3-hydroxy-4-methoxybenzamide is COc1ccc(C(=O)Nc2ccc(C)c(N)c2)cc1O.
What is the InChIKey of N-(3-amino-4-methylphenyl)-3-hydroxy-4-methoxybenzamide?
The InChIKey is GIWZGJFMNFBAEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O3/c1-9-3-5-11(8-12(9)16)17-15(19)10-4-6-14(20-2)13(18)7-10/h3-8,18H,16H2,1-2H3,(H,17,19).
What are the key properties of N-(3-amino-4-methylphenyl)-3-hydroxy-4-methoxybenzamide?
N-(3-amino-4-methylphenyl)-3-hydroxy-4-methoxybenzamide has a molecular weight of 272.30 g/mol, XLogP of 2.54, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-4-methylphenyl)-3-hydroxy-4-methoxybenzamide is sourced from PubChem (CID 79726156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).