N-[(4-chlorophenyl)methyl]-4-hydroxy-2-methylbenzamide

C15H14ClNO2 — CID 103863411

IUPACN-[(4-chlorophenyl)methyl]-4-hydroxy-2-methylbenzamide
SMILESCc1cc(O)ccc1C(=O)NCc1ccc(Cl)cc1
InChIInChI=1S/C15H14ClNO2/c1-10-8-13(18)6-7-14(10)15(19)17-9-11-2-4-12(16)5-3-11/h2-8,18H,9H2,1H3,(H,17,19)
InChIKeyZGIFVDFZWJSELX-UHFFFAOYSA-N
MW275.74 g/mol
LogP3.28
Rot. Bonds3

About N-[(4-chlorophenyl)methyl]-4-hydroxy-2-methylbenzamide

N-[(4-chlorophenyl)methyl]-4-hydroxy-2-methylbenzamide (PubChem CID 103863411) has the molecular formula C15H14ClNO2 and a molecular weight of 275.74 g/mol. Its IUPAC name is N-[(4-chlorophenyl)methyl]-4-hydroxy-2-methylbenzamide.

Molecular Properties

Compound NameN-[(4-chlorophenyl)methyl]-4-hydroxy-2-methylbenzamide
PubChem CID103863411
Molecular FormulaC15H14ClNO2
Molecular Weight275.74 g/mol
Exact Mass275.07
IUPAC NameN-[(4-chlorophenyl)methyl]-4-hydroxy-2-methylbenzamide
SMILESCc1cc(O)ccc1C(=O)NCc1ccc(Cl)cc1
InChIInChI=1S/C15H14ClNO2/c1-10-8-13(18)6-7-14(10)15(19)17-9-11-2-4-12(16)5-3-11/h2-8,18H,9H2,1H3,(H,17,19)
InChIKeyZGIFVDFZWJSELX-UHFFFAOYSA-N
XLogP3.28
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 ≤ 53.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-hydroxy-N-[(4-hydroxyphenyl)methyl]-2-methylbenzamide
CID 103867255
N-[[4-(aminomethyl)phenyl]methyl]-4-hydroxy-2-methylbenzamide
CID 107670516
N-[(4-chlorophenyl)methyl]-2-hydroxy-4-methylbenzamide
CID 25243582
N-[(2-chlorophenyl)methyl]-4-hydroxy-2-methylbenzamide
CID 103863466
N-[(3-amino-4-methoxyphenyl)methyl]-4-hydroxy-2-methylbenzamide
CID 107670603
N-[[4-(chloromethyl)phenyl]methyl]-2,4-dimethylbenzamide
CID 107233380
N-[(4-chlorophenyl)methyl]-2-fluoro-3-methylbenzamide
CID 80718402
4-chloro-2-methyl-N-(1H-pyrrol-3-ylmethyl)benzamide
CID 106385485
N-(3-aminopropyl)-4-hydroxy-2-methylbenzamide
CID 107670534
N-[(4-chlorophenyl)methyl]-2,4-bis(hydroxymethyl)benzamide
CID 90945452
N-[(3-hydroxyphenyl)methyl]-2,4-dimethylbenzamide
CID 47292289
N-(4-chlorobutyl)-4-hydroxy-2-methylbenzamide
CID 107673272

Frequently Asked Questions

What is the IUPAC name of N-[(4-chlorophenyl)methyl]-4-hydroxy-2-methylbenzamide?
The IUPAC name of N-[(4-chlorophenyl)methyl]-4-hydroxy-2-methylbenzamide (CID 103863411) is N-[(4-chlorophenyl)methyl]-4-hydroxy-2-methylbenzamide.
What is the SMILES notation for N-[(4-chlorophenyl)methyl]-4-hydroxy-2-methylbenzamide?
The canonical SMILES for N-[(4-chlorophenyl)methyl]-4-hydroxy-2-methylbenzamide is Cc1cc(O)ccc1C(=O)NCc1ccc(Cl)cc1.
What is the InChIKey of N-[(4-chlorophenyl)methyl]-4-hydroxy-2-methylbenzamide?
The InChIKey is ZGIFVDFZWJSELX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClNO2/c1-10-8-13(18)6-7-14(10)15(19)17-9-11-2-4-12(16)5-3-11/h2-8,18H,9H2,1H3,(H,17,19).
What are the key properties of N-[(4-chlorophenyl)methyl]-4-hydroxy-2-methylbenzamide?
N-[(4-chlorophenyl)methyl]-4-hydroxy-2-methylbenzamide has a molecular weight of 275.74 g/mol, XLogP of 3.28, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-chlorophenyl)methyl]-4-hydroxy-2-methylbenzamide is sourced from PubChem (CID 103863411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).