3-chloro-4-methoxy-N-(4-methylphenyl)benzamide

C15H14ClNO2 — CID 2976183

IUPAC3-chloro-4-methoxy-N-(4-methylphenyl)benzamide
SMILESCOc1ccc(C(=O)Nc2ccc(C)cc2)cc1Cl
InChIInChI=1S/C15H14ClNO2/c1-10-3-6-12(7-4-10)17-15(18)11-5-8-14(19-2)13(16)9-11/h3-9H,1-2H3,(H,17,18)
InChIKeyYVAVRHSSYLYVEL-UHFFFAOYSA-N
MW275.74 g/mol
LogP3.91
Rot. Bonds3

About 3-chloro-4-methoxy-N-(4-methylphenyl)benzamide

3-chloro-4-methoxy-N-(4-methylphenyl)benzamide (PubChem CID 2976183) has the molecular formula C15H14ClNO2 and a molecular weight of 275.74 g/mol. Its IUPAC name is 3-chloro-4-methoxy-N-(4-methylphenyl)benzamide.

Molecular Properties

Compound Name3-chloro-4-methoxy-N-(4-methylphenyl)benzamide
PubChem CID2976183
Molecular FormulaC15H14ClNO2
Molecular Weight275.74 g/mol
Exact Mass275.07
IUPAC Name3-chloro-4-methoxy-N-(4-methylphenyl)benzamide
SMILESCOc1ccc(C(=O)Nc2ccc(C)cc2)cc1Cl
InChIInChI=1S/C15H14ClNO2/c1-10-3-6-12(7-4-10)17-15(18)11-5-8-14(19-2)13(16)9-11/h3-9H,1-2H3,(H,17,18)
InChIKeyYVAVRHSSYLYVEL-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

3-chloro-4-methoxy-N-(4-methoxyphenyl)benzamide
CID 44871411
N-(3-bromo-4-methoxyphenyl)-3-chloro-4-methoxybenzamide
CID 3529705
N-(3-chloro-4-methoxyphenyl)-3,4-dimethoxybenzamide
CID 795184
ethane;4-methoxy-3-methyl-N-(4-methylphenyl)benzamide
CID 54213440
3-chloro-N-(3,5-dichloro-4-hydroxyphenyl)-4-methoxybenzamide
CID 2994955
3-methoxy-4-methyl-N-(4-methylphenyl)benzamide
CID 9071746
3-chloro-N-(4-iodo-3,5-dimethylphenyl)-4-methoxybenzamide
CID 17313445
4-bromo-3-chloro-N-(3-chloro-4-methoxyphenyl)benzamide
CID 81307448
3-methoxy-N-(4-methylphenyl)-4-propan-2-yloxybenzamide
CID 6457881
N-[4-(aziridin-1-ylsulfonyl)phenyl]-3-chloro-4-methoxybenzamide
CID 155705982
3-chloro-4-methoxy-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]benzamide
CID 6964895
3-chloro-N-[4-chloro-3-(trifluoromethyl)phenyl]-4-methoxybenzamide
CID 44871489

Frequently Asked Questions

What is the IUPAC name of 3-chloro-4-methoxy-N-(4-methylphenyl)benzamide?
The IUPAC name of 3-chloro-4-methoxy-N-(4-methylphenyl)benzamide (CID 2976183) is 3-chloro-4-methoxy-N-(4-methylphenyl)benzamide.
What is the SMILES notation for 3-chloro-4-methoxy-N-(4-methylphenyl)benzamide?
The canonical SMILES for 3-chloro-4-methoxy-N-(4-methylphenyl)benzamide is COc1ccc(C(=O)Nc2ccc(C)cc2)cc1Cl.
What is the InChIKey of 3-chloro-4-methoxy-N-(4-methylphenyl)benzamide?
The InChIKey is YVAVRHSSYLYVEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClNO2/c1-10-3-6-12(7-4-10)17-15(18)11-5-8-14(19-2)13(16)9-11/h3-9H,1-2H3,(H,17,18).
What are the key properties of 3-chloro-4-methoxy-N-(4-methylphenyl)benzamide?
3-chloro-4-methoxy-N-(4-methylphenyl)benzamide 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 3-chloro-4-methoxy-N-(4-methylphenyl)benzamide is sourced from PubChem (CID 2976183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).