2-hydroxy-N-[(3-hydroxyphenyl)methyl]-4-methoxybenzamide

C15H15NO4 — CID 47292166

IUPAC2-hydroxy-N-[(3-hydroxyphenyl)methyl]-4-methoxybenzamide
SMILESCOc1ccc(C(=O)NCc2cccc(O)c2)c(O)c1
InChIInChI=1S/C15H15NO4/c1-20-12-5-6-13(14(18)8-12)15(19)16-9-10-3-2-4-11(17)7-10/h2-8,17-18H,9H2,1H3,(H,16,19)
InChIKeyHLKALLDSNWSIAC-UHFFFAOYSA-N
MW273.29 g/mol
LogP2.04
Rot. Bonds4

About 2-hydroxy-N-[(3-hydroxyphenyl)methyl]-4-methoxybenzamide

2-hydroxy-N-[(3-hydroxyphenyl)methyl]-4-methoxybenzamide (PubChem CID 47292166) has the molecular formula C15H15NO4 and a molecular weight of 273.29 g/mol. Its IUPAC name is 2-hydroxy-N-[(3-hydroxyphenyl)methyl]-4-methoxybenzamide.

Molecular Properties

Compound Name2-hydroxy-N-[(3-hydroxyphenyl)methyl]-4-methoxybenzamide
PubChem CID47292166
Molecular FormulaC15H15NO4
Molecular Weight273.29 g/mol
Exact Mass273.10
IUPAC Name2-hydroxy-N-[(3-hydroxyphenyl)methyl]-4-methoxybenzamide
SMILESCOc1ccc(C(=O)NCc2cccc(O)c2)c(O)c1
InChIInChI=1S/C15H15NO4/c1-20-12-5-6-13(14(18)8-12)15(19)16-9-10-3-2-4-11(17)7-10/h2-8,17-18H,9H2,1H3,(H,16,19)
InChIKeyHLKALLDSNWSIAC-UHFFFAOYSA-N
XLogP2.04
TPSA78.79 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.29
LogP ≤ 52.04
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(3-hydroxyphenyl)methyl]-2,4-dimethoxybenzamide
CID 61018179
N-[(3-hydroxyphenyl)methyl]-3-methoxybenzamide
CID 47292174
N-[(3-hydroxyphenyl)methyl]-2-(3-methoxyphenyl)acetamide
CID 47292082
3-hydroxy-N-[(3-methoxyphenyl)methyl]naphthalene-2-carboxamide
CID 27231686
2-hydroxy-5-methoxy-N-[(3-methylphenyl)methyl]benzamide
CID 60728918
2-iodo-N-[(3-methoxyphenyl)methyl]benzamide
CID 2468432
N-[(3-hydroxyphenyl)methyl]-2,4-dimethylbenzamide
CID 47292289
N-(2,6-diethylphenyl)-2-hydroxy-4-methoxybenzamide
CID 43824721
4-methoxy-N-[[3-[[(4-methoxybenzoyl)amino]methyl]phenyl]methyl]benzamide
CID 4118576
1-[2-(3-hydroxyphenyl)ethyl]-3-[(3-methoxyphenyl)methyl]urea
CID 60602886
2,3,4-trifluoro-N-[(3-methoxyphenyl)methyl]benzamide
CID 110779927
2,4-dibromo-N-[(3-methoxyphenyl)methyl]benzamide
CID 103882071

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-N-[(3-hydroxyphenyl)methyl]-4-methoxybenzamide?
The IUPAC name of 2-hydroxy-N-[(3-hydroxyphenyl)methyl]-4-methoxybenzamide (CID 47292166) is 2-hydroxy-N-[(3-hydroxyphenyl)methyl]-4-methoxybenzamide.
What is the SMILES notation for 2-hydroxy-N-[(3-hydroxyphenyl)methyl]-4-methoxybenzamide?
The canonical SMILES for 2-hydroxy-N-[(3-hydroxyphenyl)methyl]-4-methoxybenzamide is COc1ccc(C(=O)NCc2cccc(O)c2)c(O)c1.
What is the InChIKey of 2-hydroxy-N-[(3-hydroxyphenyl)methyl]-4-methoxybenzamide?
The InChIKey is HLKALLDSNWSIAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NO4/c1-20-12-5-6-13(14(18)8-12)15(19)16-9-10-3-2-4-11(17)7-10/h2-8,17-18H,9H2,1H3,(H,16,19).
What are the key properties of 2-hydroxy-N-[(3-hydroxyphenyl)methyl]-4-methoxybenzamide?
2-hydroxy-N-[(3-hydroxyphenyl)methyl]-4-methoxybenzamide has a molecular weight of 273.29 g/mol, XLogP of 2.04, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-N-[(3-hydroxyphenyl)methyl]-4-methoxybenzamide is sourced from PubChem (CID 47292166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).