N-[(4-chlorophenyl)methyl]-4-hydroxy-N-methylbenzamide

C15H14ClNO2 — CID 60628298

IUPACN-[(4-chlorophenyl)methyl]-4-hydroxy-N-methylbenzamide
SMILESCN(Cc1ccc(Cl)cc1)C(=O)c1ccc(O)cc1
InChIInChI=1S/C15H14ClNO2/c1-17(10-11-2-6-13(16)7-3-11)15(19)12-4-8-14(18)9-5-12/h2-9,18H,10H2,1H3
InChIKeyAITWJCDBAXQAIV-UHFFFAOYSA-N
MW275.74 g/mol
LogP3.32
Rot. Bonds3

About N-[(4-chlorophenyl)methyl]-4-hydroxy-N-methylbenzamide

N-[(4-chlorophenyl)methyl]-4-hydroxy-N-methylbenzamide (PubChem CID 60628298) has the molecular formula C15H14ClNO2 and a molecular weight of 275.74 g/mol. Its IUPAC name is N-[(4-chlorophenyl)methyl]-4-hydroxy-N-methylbenzamide.

Molecular Properties

Compound NameN-[(4-chlorophenyl)methyl]-4-hydroxy-N-methylbenzamide
PubChem CID60628298
Molecular FormulaC15H14ClNO2
Molecular Weight275.74 g/mol
Exact Mass275.07
IUPAC NameN-[(4-chlorophenyl)methyl]-4-hydroxy-N-methylbenzamide
SMILESCN(Cc1ccc(Cl)cc1)C(=O)c1ccc(O)cc1
InChIInChI=1S/C15H14ClNO2/c1-17(10-11-2-6-13(16)7-3-11)15(19)12-4-8-14(18)9-5-12/h2-9,18H,10H2,1H3
InChIKeyAITWJCDBAXQAIV-UHFFFAOYSA-N
XLogP3.32
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.74
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-tert-butyl-N-[(4-chlorophenyl)methyl]-N-methylbenzamide
CID 99955818
N-[(4-chlorophenyl)methyl]-N-methyl-4-(methylsulfonylmethyl)benzamide
CID 31987355
4-acetamido-N-[(4-hydroxyphenyl)methyl]-N-methylbenzamide
CID 123178559
N-[(4-chlorophenyl)methyl]-3,4-dimethoxy-N-methylbenzamide
CID 28632210
N-[(4-chlorophenyl)methyl]-N-methyl-4-(morpholin-4-ylmethyl)benzamide
CID 43908262
4-[(4-chlorophenyl)sulfanylmethyl]-N-methyl-N-[(4-methylphenyl)methyl]benzamide
CID 7958609
N-[(4-hydroxyphenyl)methyl]-N-methylpyrimidine-5-carboxamide
CID 104629381
N-[(4-chlorophenyl)methyl]-4-(cyclopropanecarbonylamino)-N-methylbenzamide
CID 31987516
N-[(4-chlorophenyl)methyl]-3-(dimethylamino)-N-methylbenzamide
CID 78768490
N-[(4-chlorophenyl)methyl]-N,3-dimethyl-4-(methylamino)benzamide
CID 63213909
N-[(4-hydroxyphenyl)methyl]-N,5-dimethylfuran-3-carboxamide
CID 114821401
N-[(4-chlorophenyl)methyl]-N,1-dimethylpyrazole-4-carboxamide
CID 86908026

Frequently Asked Questions

What is the IUPAC name of N-[(4-chlorophenyl)methyl]-4-hydroxy-N-methylbenzamide?
The IUPAC name of N-[(4-chlorophenyl)methyl]-4-hydroxy-N-methylbenzamide (CID 60628298) is N-[(4-chlorophenyl)methyl]-4-hydroxy-N-methylbenzamide.
What is the SMILES notation for N-[(4-chlorophenyl)methyl]-4-hydroxy-N-methylbenzamide?
The canonical SMILES for N-[(4-chlorophenyl)methyl]-4-hydroxy-N-methylbenzamide is CN(Cc1ccc(Cl)cc1)C(=O)c1ccc(O)cc1.
What is the InChIKey of N-[(4-chlorophenyl)methyl]-4-hydroxy-N-methylbenzamide?
The InChIKey is AITWJCDBAXQAIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClNO2/c1-17(10-11-2-6-13(16)7-3-11)15(19)12-4-8-14(18)9-5-12/h2-9,18H,10H2,1H3.
What are the key properties of N-[(4-chlorophenyl)methyl]-4-hydroxy-N-methylbenzamide?
N-[(4-chlorophenyl)methyl]-4-hydroxy-N-methylbenzamide has a molecular weight of 275.74 g/mol, XLogP of 3.32, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-chlorophenyl)methyl]-4-hydroxy-N-methylbenzamide is sourced from PubChem (CID 60628298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).