N-(3-acetylphenyl)-3-chloro-4-hydroxybenzamide

C15H12ClNO3 — CID 24710986

IUPACN-(3-acetylphenyl)-3-chloro-4-hydroxybenzamide
SMILESCC(=O)c1cccc(NC(=O)c2ccc(O)c(Cl)c2)c1
InChIInChI=1S/C15H12ClNO3/c1-9(18)10-3-2-4-12(7-10)17-15(20)11-5-6-14(19)13(16)8-11/h2-8,19H,1H3,(H,17,20)
InChIKeyKUUHERVRBYJWIL-UHFFFAOYSA-N
MW289.72 g/mol
LogP3.50
Rot. Bonds3

About N-(3-acetylphenyl)-3-chloro-4-hydroxybenzamide

N-(3-acetylphenyl)-3-chloro-4-hydroxybenzamide (PubChem CID 24710986) has the molecular formula C15H12ClNO3 and a molecular weight of 289.72 g/mol. Its IUPAC name is N-(3-acetylphenyl)-3-chloro-4-hydroxybenzamide.

Molecular Properties

Compound NameN-(3-acetylphenyl)-3-chloro-4-hydroxybenzamide
PubChem CID24710986
Molecular FormulaC15H12ClNO3
Molecular Weight289.72 g/mol
Exact Mass289.05
IUPAC NameN-(3-acetylphenyl)-3-chloro-4-hydroxybenzamide
SMILESCC(=O)c1cccc(NC(=O)c2ccc(O)c(Cl)c2)c1
InChIInChI=1S/C15H12ClNO3/c1-9(18)10-3-2-4-12(7-10)17-15(20)11-5-6-14(19)13(16)8-11/h2-8,19H,1H3,(H,17,20)
InChIKeyKUUHERVRBYJWIL-UHFFFAOYSA-N
XLogP3.50
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.72
LogP ≤ 53.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-acetylphenyl)-4-hydroxy-3-methylbenzamide
CID 103955356
N-[3-(bromomethyl)phenyl]-3-chloro-4-hydroxybenzamide
CID 114307203
3-chloro-N-(4-chloro-3-hydroxyphenyl)-4-hydroxybenzamide
CID 64788669
N-(3-acetylphenyl)naphthalene-2-carboxamide
CID 2274462
N-(3-acetylphenyl)-4-tert-butylbenzamide
CID 722882
N-(3-acetylphenyl)-3-(chloromethyl)benzamide
CID 43346840
3,4-dihydroxy-N-[3-[(Z)-N-hydroxy-C-methylcarbonimidoyl]phenyl]benzamide
CID 107728450
N-[3-(2-aminoethoxy)phenyl]-3-chloro-4-hydroxybenzamide
CID 63121177
N-(3-acetamidophenyl)-3-chloro-4-fluorobenzamide
CID 110764762
N-(3-acetylphenyl)-3,5-dimethylbenzamide
CID 969392
3-chloro-4-fluoro-N-[3-[(Z)-N-hydroxy-C-methylcarbonimidoyl]phenyl]benzamide
CID 82876177
N-(3-acetylphenyl)-3-(dimethylamino)benzamide
CID 7922589

Frequently Asked Questions

What is the IUPAC name of N-(3-acetylphenyl)-3-chloro-4-hydroxybenzamide?
The IUPAC name of N-(3-acetylphenyl)-3-chloro-4-hydroxybenzamide (CID 24710986) is N-(3-acetylphenyl)-3-chloro-4-hydroxybenzamide.
What is the SMILES notation for N-(3-acetylphenyl)-3-chloro-4-hydroxybenzamide?
The canonical SMILES for N-(3-acetylphenyl)-3-chloro-4-hydroxybenzamide is CC(=O)c1cccc(NC(=O)c2ccc(O)c(Cl)c2)c1.
What is the InChIKey of N-(3-acetylphenyl)-3-chloro-4-hydroxybenzamide?
The InChIKey is KUUHERVRBYJWIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12ClNO3/c1-9(18)10-3-2-4-12(7-10)17-15(20)11-5-6-14(19)13(16)8-11/h2-8,19H,1H3,(H,17,20).
What are the key properties of N-(3-acetylphenyl)-3-chloro-4-hydroxybenzamide?
N-(3-acetylphenyl)-3-chloro-4-hydroxybenzamide has a molecular weight of 289.72 g/mol, XLogP of 3.50, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetylphenyl)-3-chloro-4-hydroxybenzamide is sourced from PubChem (CID 24710986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).