3-chloro-4-hydroxy-N-(2-methylphenyl)benzamide

C14H12ClNO2 — CID 18104256

IUPAC3-chloro-4-hydroxy-N-(2-methylphenyl)benzamide
SMILESCc1ccccc1NC(=O)c1ccc(O)c(Cl)c1
InChIInChI=1S/C14H12ClNO2/c1-9-4-2-3-5-12(9)16-14(18)10-6-7-13(17)11(15)8-10/h2-8,17H,1H3,(H,16,18)
InChIKeyWAIRFPCNDIAGME-UHFFFAOYSA-N
MW261.71 g/mol
LogP3.61
Rot. Bonds2

About 3-chloro-4-hydroxy-N-(2-methylphenyl)benzamide

3-chloro-4-hydroxy-N-(2-methylphenyl)benzamide (PubChem CID 18104256) has the molecular formula C14H12ClNO2 and a molecular weight of 261.71 g/mol. Its IUPAC name is 3-chloro-4-hydroxy-N-(2-methylphenyl)benzamide.

Molecular Properties

Compound Name3-chloro-4-hydroxy-N-(2-methylphenyl)benzamide
PubChem CID18104256
Molecular FormulaC14H12ClNO2
Molecular Weight261.71 g/mol
Exact Mass261.06
IUPAC Name3-chloro-4-hydroxy-N-(2-methylphenyl)benzamide
SMILESCc1ccccc1NC(=O)c1ccc(O)c(Cl)c1
InChIInChI=1S/C14H12ClNO2/c1-9-4-2-3-5-12(9)16-14(18)10-6-7-13(17)11(15)8-10/h2-8,17H,1H3,(H,16,18)
InChIKeyWAIRFPCNDIAGME-UHFFFAOYSA-N
XLogP3.61
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.71
LogP ≤ 53.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3,4-dihydroxy-N-(2-methylphenyl)benzamide
CID 57150208
N-(2-chlorophenyl)-4-hydroxy-3-methylbenzamide
CID 103956204
3-amino-4,5-dichloro-N-(2-methylphenyl)benzamide
CID 61090802
N-(2-methylphenyl)naphthalene-2-carboxamide
CID 790563
5-chloro-2-hydroxy-N-(2-methylphenyl)benzamide
CID 970572
3-chloro-N-(2-fluoro-4-methylphenyl)-4-hydroxybenzamide
CID 28881729
3-chloro-N-(2-chloro-4-hydroxyphenyl)-4-hydroxybenzamide
CID 64787162
2-[(3-chloro-4-methylbenzoyl)amino]benzoic acid
CID 63194782
N-(5-tert-butyl-2-hydroxyphenyl)-3-chloro-4-hydroxybenzamide
CID 29265235
3-chloro-4-hydroxy-N-[1-(2-methylphenyl)ethyl]benzamide
CID 18111876
4-chloro-N-(2-methylphenyl)-3-[(2-phenylacetyl)amino]benzamide
CID 7312019
ethane;4-methyl-N-(2-methylphenyl)benzamide
CID 145337643

Frequently Asked Questions

What is the IUPAC name of 3-chloro-4-hydroxy-N-(2-methylphenyl)benzamide?
The IUPAC name of 3-chloro-4-hydroxy-N-(2-methylphenyl)benzamide (CID 18104256) is 3-chloro-4-hydroxy-N-(2-methylphenyl)benzamide.
What is the SMILES notation for 3-chloro-4-hydroxy-N-(2-methylphenyl)benzamide?
The canonical SMILES for 3-chloro-4-hydroxy-N-(2-methylphenyl)benzamide is Cc1ccccc1NC(=O)c1ccc(O)c(Cl)c1.
What is the InChIKey of 3-chloro-4-hydroxy-N-(2-methylphenyl)benzamide?
The InChIKey is WAIRFPCNDIAGME-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12ClNO2/c1-9-4-2-3-5-12(9)16-14(18)10-6-7-13(17)11(15)8-10/h2-8,17H,1H3,(H,16,18).
What are the key properties of 3-chloro-4-hydroxy-N-(2-methylphenyl)benzamide?
3-chloro-4-hydroxy-N-(2-methylphenyl)benzamide has a molecular weight of 261.71 g/mol, XLogP of 3.61, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-4-hydroxy-N-(2-methylphenyl)benzamide is sourced from PubChem (CID 18104256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).