2-amino-N-(2-hydroxy-4-methoxyphenyl)-5-methylbenzamide

C15H16N2O3 — CID 102695337

IUPAC2-amino-N-(2-hydroxy-4-methoxyphenyl)-5-methylbenzamide
SMILESCOc1ccc(NC(=O)c2cc(C)ccc2N)c(O)c1
InChIInChI=1S/C15H16N2O3/c1-9-3-5-12(16)11(7-9)15(19)17-13-6-4-10(20-2)8-14(13)18/h3-8,18H,16H2,1-2H3,(H,17,19)
InChIKeyWKBYMKFOJQUGCQ-UHFFFAOYSA-N
MW272.30 g/mol
LogP2.54
Rot. Bonds3

About 2-amino-N-(2-hydroxy-4-methoxyphenyl)-5-methylbenzamide

2-amino-N-(2-hydroxy-4-methoxyphenyl)-5-methylbenzamide (PubChem CID 102695337) has the molecular formula C15H16N2O3 and a molecular weight of 272.30 g/mol. Its IUPAC name is 2-amino-N-(2-hydroxy-4-methoxyphenyl)-5-methylbenzamide.

Molecular Properties

Compound Name2-amino-N-(2-hydroxy-4-methoxyphenyl)-5-methylbenzamide
PubChem CID102695337
Molecular FormulaC15H16N2O3
Molecular Weight272.30 g/mol
Exact Mass272.12
IUPAC Name2-amino-N-(2-hydroxy-4-methoxyphenyl)-5-methylbenzamide
SMILESCOc1ccc(NC(=O)c2cc(C)ccc2N)c(O)c1
InChIInChI=1S/C15H16N2O3/c1-9-3-5-12(16)11(7-9)15(19)17-13-6-4-10(20-2)8-14(13)18/h3-8,18H,16H2,1-2H3,(H,17,19)
InChIKeyWKBYMKFOJQUGCQ-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'}, {'alert_name': 'catechol', 'substructure': 'N/A'}

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Related Compounds

N-(2-amino-4-methylphenyl)-2-hydroxy-4-methoxybenzamide
CID 43259027
N-(2-hydroxy-4-methylphenyl)-2,5-dimethoxybenzamide
CID 18108995
2-amino-N-(2-chloro-5-methylphenyl)-5-methoxybenzamide
CID 107624036
2-amino-N-(2-hydroxy-5-methylphenyl)-4-methoxybenzamide
CID 80504227
2-amino-N-(3-methoxyphenyl)-5-methylbenzamide
CID 55069541
2-amino-N-(4-iodo-2-methylphenyl)-5-methoxybenzamide
CID 115412666
N-(2-bromo-4-methylphenyl)-2-hydroxy-5-methoxybenzamide
CID 60715660
N-(2-amino-4-methylphenyl)-2-fluoro-4-methoxybenzamide
CID 102881866
2-amino-N-(2-carbamoylphenyl)-5-methoxybenzamide
CID 60955502
N-(4-amino-2,5-dimethylphenyl)-2-hydroxy-5-methoxybenzamide
CID 103144431
N-(2-amino-5-methylphenyl)-2-hydroxy-5-methylbenzamide
CID 112557255
2-amino-N-(4-fluoro-2-iodophenyl)-5-methoxybenzamide
CID 79769439

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2-hydroxy-4-methoxyphenyl)-5-methylbenzamide?
The IUPAC name of 2-amino-N-(2-hydroxy-4-methoxyphenyl)-5-methylbenzamide (CID 102695337) is 2-amino-N-(2-hydroxy-4-methoxyphenyl)-5-methylbenzamide.
What is the SMILES notation for 2-amino-N-(2-hydroxy-4-methoxyphenyl)-5-methylbenzamide?
The canonical SMILES for 2-amino-N-(2-hydroxy-4-methoxyphenyl)-5-methylbenzamide is COc1ccc(NC(=O)c2cc(C)ccc2N)c(O)c1.
What is the InChIKey of 2-amino-N-(2-hydroxy-4-methoxyphenyl)-5-methylbenzamide?
The InChIKey is WKBYMKFOJQUGCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O3/c1-9-3-5-12(16)11(7-9)15(19)17-13-6-4-10(20-2)8-14(13)18/h3-8,18H,16H2,1-2H3,(H,17,19).
What are the key properties of 2-amino-N-(2-hydroxy-4-methoxyphenyl)-5-methylbenzamide?
2-amino-N-(2-hydroxy-4-methoxyphenyl)-5-methylbenzamide 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 2-amino-N-(2-hydroxy-4-methoxyphenyl)-5-methylbenzamide is sourced from PubChem (CID 102695337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).