2-chloro-N-(3-methoxyphenyl)-4-methylbenzamide

C15H14ClNO2 — CID 886020

IUPAC2-chloro-N-(3-methoxyphenyl)-4-methylbenzamide
SMILESCOc1cccc(NC(=O)c2ccc(C)cc2Cl)c1
InChIInChI=1S/C15H14ClNO2/c1-10-6-7-13(14(16)8-10)15(18)17-11-4-3-5-12(9-11)19-2/h3-9H,1-2H3,(H,17,18)
InChIKeyRTJLBHQLYMYVRZ-UHFFFAOYSA-N
MW275.74 g/mol
LogP3.91
Rot. Bonds3

About 2-chloro-N-(3-methoxyphenyl)-4-methylbenzamide

2-chloro-N-(3-methoxyphenyl)-4-methylbenzamide (PubChem CID 886020) has the molecular formula C15H14ClNO2 and a molecular weight of 275.74 g/mol. Its IUPAC name is 2-chloro-N-(3-methoxyphenyl)-4-methylbenzamide.

Molecular Properties

Compound Name2-chloro-N-(3-methoxyphenyl)-4-methylbenzamide
PubChem CID886020
Molecular FormulaC15H14ClNO2
Molecular Weight275.74 g/mol
Exact Mass275.07
IUPAC Name2-chloro-N-(3-methoxyphenyl)-4-methylbenzamide
SMILESCOc1cccc(NC(=O)c2ccc(C)cc2Cl)c1
InChIInChI=1S/C15H14ClNO2/c1-10-6-7-13(14(16)8-10)15(18)17-11-4-3-5-12(9-11)19-2/h3-9H,1-2H3,(H,17,18)
InChIKeyRTJLBHQLYMYVRZ-UHFFFAOYSA-N
XLogP3.91
TPSA38.33 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 ≤ 53.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-chloro-N-(3,5-dimethoxyphenyl)-4-methylbenzamide
CID 885585
3-chloro-N-(3-methoxyphenyl)pyridine-4-carboxamide
CID 66462058
2-amino-N-(3-methoxyphenyl)-5-methylbenzamide
CID 55069541
2-chloro-N-(2,4-dimethoxyphenyl)-4-methylbenzamide
CID 885610
2-hydroxy-4-methoxy-N-(3-methoxyphenyl)benzamide
CID 27167303
5-amino-2,3-dichloro-N-(3-methoxyphenyl)benzamide
CID 107183164
2,4-dichloro-N-(3-propan-2-yloxyphenyl)benzamide
CID 17154669
4-amino-N-(3-methoxyphenyl)-2,3-dimethylbenzamide
CID 68975139
5-chloro-4-iodo-2-methoxy-N-(3-methoxyphenyl)benzamide
CID 52577352
3,6-dichloro-N-(3-methoxyphenyl)pyridazine-4-carboxamide
CID 6405267
N-(3-methoxyphenyl)-6-methyl-1H-indole-2-carboxamide
CID 113207365
2-chloro-4-methyl-N-[3-[methyl(methylsulfonyl)amino]phenyl]benzamide
CID 100520518

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(3-methoxyphenyl)-4-methylbenzamide?
The IUPAC name of 2-chloro-N-(3-methoxyphenyl)-4-methylbenzamide (CID 886020) is 2-chloro-N-(3-methoxyphenyl)-4-methylbenzamide.
What is the SMILES notation for 2-chloro-N-(3-methoxyphenyl)-4-methylbenzamide?
The canonical SMILES for 2-chloro-N-(3-methoxyphenyl)-4-methylbenzamide is COc1cccc(NC(=O)c2ccc(C)cc2Cl)c1.
What is the InChIKey of 2-chloro-N-(3-methoxyphenyl)-4-methylbenzamide?
The InChIKey is RTJLBHQLYMYVRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClNO2/c1-10-6-7-13(14(16)8-10)15(18)17-11-4-3-5-12(9-11)19-2/h3-9H,1-2H3,(H,17,18).
What are the key properties of 2-chloro-N-(3-methoxyphenyl)-4-methylbenzamide?
2-chloro-N-(3-methoxyphenyl)-4-methylbenzamide has a molecular weight of 275.74 g/mol, XLogP of 3.91, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(3-methoxyphenyl)-4-methylbenzamide is sourced from PubChem (CID 886020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).