2-chloro-N-[4-(1-hydroxyethyl)phenyl]benzamide

C15H14ClNO2 — CID 43508377

IUPAC2-chloro-N-[4-(1-hydroxyethyl)phenyl]benzamide
SMILESCC(O)c1ccc(NC(=O)c2ccccc2Cl)cc1
InChIInChI=1S/C15H14ClNO2/c1-10(18)11-6-8-12(9-7-11)17-15(19)13-4-2-3-5-14(13)16/h2-10,18H,1H3,(H,17,19)
InChIKeyRMWWKHOFMLXOFN-UHFFFAOYSA-N
MW275.74 g/mol
LogP3.65
Rot. Bonds3

About 2-chloro-N-[4-(1-hydroxyethyl)phenyl]benzamide

2-chloro-N-[4-(1-hydroxyethyl)phenyl]benzamide (PubChem CID 43508377) has the molecular formula C15H14ClNO2 and a molecular weight of 275.74 g/mol. Its IUPAC name is 2-chloro-N-[4-(1-hydroxyethyl)phenyl]benzamide.

Molecular Properties

Compound Name2-chloro-N-[4-(1-hydroxyethyl)phenyl]benzamide
PubChem CID43508377
Molecular FormulaC15H14ClNO2
Molecular Weight275.74 g/mol
Exact Mass275.07
IUPAC Name2-chloro-N-[4-(1-hydroxyethyl)phenyl]benzamide
SMILESCC(O)c1ccc(NC(=O)c2ccccc2Cl)cc1
InChIInChI=1S/C15H14ClNO2/c1-10(18)11-6-8-12(9-7-11)17-15(19)13-4-2-3-5-14(13)16/h2-10,18H,1H3,(H,17,19)
InChIKeyRMWWKHOFMLXOFN-UHFFFAOYSA-N
XLogP3.65
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.74
LogP ≤ 53.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[4-(1-hydroxyethyl)phenyl]-2-methylbenzamide
CID 43417161
2-fluoro-N-[4-(1-hydroxyethyl)phenyl]-3-methylbenzamide
CID 81477970
2-chloro-N-[4-[(1R)-1-hydroxyethyl]phenyl]-4-nitrobenzamide
CID 100803493
2-chloro-N-(4-sulfanylphenyl)benzamide
CID 27137419
2-chloro-N-[4-(trifluoromethyl)phenyl]benzamide
CID 2064029
3-amino-2-chloro-N-(4-propan-2-ylphenyl)benzamide
CID 115930102
N-[4-(butan-2-ylcarbamoyl)phenyl]-2-chlorobenzamide
CID 17201202
N-(3-acetyl-4-chlorophenyl)-2-chlorobenzamide
CID 22888926
2-chloro-N-(4-chlorophenyl)benzamide;4-chloro-N-(4-chlorophenyl)benzamide
CID 159735192
2-hydrazinyl-N-(4-propan-2-ylphenyl)benzamide
CID 62235993
2-chloro-N-[4-(dimethylcarbamoyl)phenyl]benzamide
CID 8698586
2-[[4-(1-hydroxyethyl)benzoyl]amino]-N-(4-methoxyphenyl)benzamide
CID 10620419

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[4-(1-hydroxyethyl)phenyl]benzamide?
The IUPAC name of 2-chloro-N-[4-(1-hydroxyethyl)phenyl]benzamide (CID 43508377) is 2-chloro-N-[4-(1-hydroxyethyl)phenyl]benzamide.
What is the SMILES notation for 2-chloro-N-[4-(1-hydroxyethyl)phenyl]benzamide?
The canonical SMILES for 2-chloro-N-[4-(1-hydroxyethyl)phenyl]benzamide is CC(O)c1ccc(NC(=O)c2ccccc2Cl)cc1.
What is the InChIKey of 2-chloro-N-[4-(1-hydroxyethyl)phenyl]benzamide?
The InChIKey is RMWWKHOFMLXOFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClNO2/c1-10(18)11-6-8-12(9-7-11)17-15(19)13-4-2-3-5-14(13)16/h2-10,18H,1H3,(H,17,19).
What are the key properties of 2-chloro-N-[4-(1-hydroxyethyl)phenyl]benzamide?
2-chloro-N-[4-(1-hydroxyethyl)phenyl]benzamide has a molecular weight of 275.74 g/mol, XLogP of 3.65, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-[4-(1-hydroxyethyl)phenyl]benzamide is sourced from PubChem (CID 43508377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).