2-hydroxy-5-methoxy-N-[(3-methylphenyl)methyl]benzamide

C16H17NO3 — CID 60728918

IUPAC2-hydroxy-5-methoxy-N-[(3-methylphenyl)methyl]benzamide
SMILESCOc1ccc(O)c(C(=O)NCc2cccc(C)c2)c1
InChIInChI=1S/C16H17NO3/c1-11-4-3-5-12(8-11)10-17-16(19)14-9-13(20-2)6-7-15(14)18/h3-9,18H,10H2,1-2H3,(H,17,19)
InChIKeyFDMMNWHRURPVQF-UHFFFAOYSA-N
MW271.32 g/mol
LogP2.64
Rot. Bonds4

About 2-hydroxy-5-methoxy-N-[(3-methylphenyl)methyl]benzamide

2-hydroxy-5-methoxy-N-[(3-methylphenyl)methyl]benzamide (PubChem CID 60728918) has the molecular formula C16H17NO3 and a molecular weight of 271.32 g/mol. Its IUPAC name is 2-hydroxy-5-methoxy-N-[(3-methylphenyl)methyl]benzamide.

Molecular Properties

Compound Name2-hydroxy-5-methoxy-N-[(3-methylphenyl)methyl]benzamide
PubChem CID60728918
Molecular FormulaC16H17NO3
Molecular Weight271.32 g/mol
Exact Mass271.12
IUPAC Name2-hydroxy-5-methoxy-N-[(3-methylphenyl)methyl]benzamide
SMILESCOc1ccc(O)c(C(=O)NCc2cccc(C)c2)c1
InChIInChI=1S/C16H17NO3/c1-11-4-3-5-12(8-11)10-17-16(19)14-9-13(20-2)6-7-15(14)18/h3-9,18H,10H2,1-2H3,(H,17,19)
InChIKeyFDMMNWHRURPVQF-UHFFFAOYSA-N
XLogP2.64
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 52.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-hydroxy-5-methoxy-N-[(4-methylphenyl)methyl]benzamide
CID 11086863
2-hydroxy-5-methoxy-N-[[3-(2,2,2-trifluoroethoxy)phenyl]methyl]benzamide
CID 112827443
2,3-dihydroxy-N-[(3-methylphenyl)methyl]benzamide
CID 114343999
2-hydroxy-N-[(3-hydroxyphenyl)methyl]-4-methoxybenzamide
CID 47292166
3-hydroxy-N-[(3-methoxyphenyl)methyl]naphthalene-2-carboxamide
CID 27231686
2-hydroxy-5-methoxy-N-[(3-methyl-2-pyridinyl)methyl]benzamide
CID 63309154
N-[(2-fluorophenyl)methyl]-2-hydroxy-5-methoxybenzamide
CID 60630315
N-[(3-hydroxyphenyl)methyl]-2,4-dimethoxybenzamide
CID 61018179
N-[2-(3-fluorophenyl)ethyl]-2-hydroxy-5-methoxybenzamide
CID 60666342
2,4-dimethoxy-3-methyl-N-[(3-methylphenyl)methyl]benzamide
CID 110763343
5-amino-2-methoxy-N-[(3-methylphenyl)methyl]benzamide
CID 61103300
4-methoxy-N-[[3-[[(4-methoxybenzoyl)amino]methyl]phenyl]methyl]benzamide
CID 4118576

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-5-methoxy-N-[(3-methylphenyl)methyl]benzamide?
The IUPAC name of 2-hydroxy-5-methoxy-N-[(3-methylphenyl)methyl]benzamide (CID 60728918) is 2-hydroxy-5-methoxy-N-[(3-methylphenyl)methyl]benzamide.
What is the SMILES notation for 2-hydroxy-5-methoxy-N-[(3-methylphenyl)methyl]benzamide?
The canonical SMILES for 2-hydroxy-5-methoxy-N-[(3-methylphenyl)methyl]benzamide is COc1ccc(O)c(C(=O)NCc2cccc(C)c2)c1.
What is the InChIKey of 2-hydroxy-5-methoxy-N-[(3-methylphenyl)methyl]benzamide?
The InChIKey is FDMMNWHRURPVQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17NO3/c1-11-4-3-5-12(8-11)10-17-16(19)14-9-13(20-2)6-7-15(14)18/h3-9,18H,10H2,1-2H3,(H,17,19).
What are the key properties of 2-hydroxy-5-methoxy-N-[(3-methylphenyl)methyl]benzamide?
2-hydroxy-5-methoxy-N-[(3-methylphenyl)methyl]benzamide has a molecular weight of 271.32 g/mol, XLogP of 2.64, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-5-methoxy-N-[(3-methylphenyl)methyl]benzamide is sourced from PubChem (CID 60728918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).