3-hydroxy-N-[(2-methoxyphenyl)methyl]-2-methylbenzamide

C16H17NO3 — CID 82786350

IUPAC3-hydroxy-N-[(2-methoxyphenyl)methyl]-2-methylbenzamide
SMILESCOc1ccccc1CNC(=O)c1cccc(O)c1C
InChIInChI=1S/C16H17NO3/c1-11-13(7-5-8-14(11)18)16(19)17-10-12-6-3-4-9-15(12)20-2/h3-9,18H,10H2,1-2H3,(H,17,19)
InChIKeyOMJCNIRXUSVDTD-UHFFFAOYSA-N
MW271.32 g/mol
LogP2.64
Rot. Bonds4

About 3-hydroxy-N-[(2-methoxyphenyl)methyl]-2-methylbenzamide

3-hydroxy-N-[(2-methoxyphenyl)methyl]-2-methylbenzamide (PubChem CID 82786350) has the molecular formula C16H17NO3 and a molecular weight of 271.32 g/mol. Its IUPAC name is 3-hydroxy-N-[(2-methoxyphenyl)methyl]-2-methylbenzamide.

Molecular Properties

Compound Name3-hydroxy-N-[(2-methoxyphenyl)methyl]-2-methylbenzamide
PubChem CID82786350
Molecular FormulaC16H17NO3
Molecular Weight271.32 g/mol
Exact Mass271.12
IUPAC Name3-hydroxy-N-[(2-methoxyphenyl)methyl]-2-methylbenzamide
SMILESCOc1ccccc1CNC(=O)c1cccc(O)c1C
InChIInChI=1S/C16H17NO3/c1-11-13(7-5-8-14(11)18)16(19)17-10-12-6-3-4-9-15(12)20-2/h3-9,18H,10H2,1-2H3,(H,17,19)
InChIKeyOMJCNIRXUSVDTD-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

2,3-dimethoxy-N-[(2-methoxyphenyl)methyl]benzamide
CID 912335
2-iodo-N-[(2-methoxyphenyl)methyl]benzamide
CID 1378811
N-[(2-methoxyphenyl)methyl]-2-methylsulfonylbenzamide
CID 18081414
[2-[(2-methoxyphenyl)methylcarbamoyl]phenyl] acetate
CID 3362065
2,4,5-trimethoxy-N-[(2-methoxyphenyl)methyl]benzamide
CID 912738
N-[(2-methoxyphenyl)methyl]quinoxaline-5-carboxamide
CID 110701357
4-methoxy-N-[(2-methoxyphenyl)methyl]-2,5-dimethylbenzamide
CID 110761590
2-methoxy-N-[(2-methoxyphenyl)methyl]-3,5-dimethylbenzamide
CID 110762822
3-fluoro-N-[(2-methoxyphenyl)methyl]-2-(methylamino)benzamide
CID 62648542
2-(difluoromethoxy)-3-methoxy-N-[(2-methoxyphenyl)methyl]benzamide
CID 51143674
N-[2-(2-methoxyphenyl)ethyl]-2,3-dimethylbenzamide
CID 26778040
N-[(2-methoxyphenyl)methyl]-2-oxo-1,3-dihydrobenzimidazole-4-carboxamide
CID 110701179

Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-N-[(2-methoxyphenyl)methyl]-2-methylbenzamide?
The IUPAC name of 3-hydroxy-N-[(2-methoxyphenyl)methyl]-2-methylbenzamide (CID 82786350) is 3-hydroxy-N-[(2-methoxyphenyl)methyl]-2-methylbenzamide.
What is the SMILES notation for 3-hydroxy-N-[(2-methoxyphenyl)methyl]-2-methylbenzamide?
The canonical SMILES for 3-hydroxy-N-[(2-methoxyphenyl)methyl]-2-methylbenzamide is COc1ccccc1CNC(=O)c1cccc(O)c1C.
What is the InChIKey of 3-hydroxy-N-[(2-methoxyphenyl)methyl]-2-methylbenzamide?
The InChIKey is OMJCNIRXUSVDTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17NO3/c1-11-13(7-5-8-14(11)18)16(19)17-10-12-6-3-4-9-15(12)20-2/h3-9,18H,10H2,1-2H3,(H,17,19).
What are the key properties of 3-hydroxy-N-[(2-methoxyphenyl)methyl]-2-methylbenzamide?
3-hydroxy-N-[(2-methoxyphenyl)methyl]-2-methylbenzamide 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 3-hydroxy-N-[(2-methoxyphenyl)methyl]-2-methylbenzamide is sourced from PubChem (CID 82786350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).