N-(2,4-dimethoxyphenyl)-3-methylbenzamide

C16H17NO3 — CID 710450

IUPACN-(2,4-dimethoxyphenyl)-3-methylbenzamide
SMILESCOc1ccc(NC(=O)c2cccc(C)c2)c(OC)c1
InChIInChI=1S/C16H17NO3/c1-11-5-4-6-12(9-11)16(18)17-14-8-7-13(19-2)10-15(14)20-3/h4-10H,1-3H3,(H,17,18)
InChIKeyAEJJFGDHYXSPNW-UHFFFAOYSA-N
MW271.32 g/mol
LogP3.26
Rot. Bonds4

About N-(2,4-dimethoxyphenyl)-3-methylbenzamide

N-(2,4-dimethoxyphenyl)-3-methylbenzamide (PubChem CID 710450) has the molecular formula C16H17NO3 and a molecular weight of 271.32 g/mol. Its IUPAC name is N-(2,4-dimethoxyphenyl)-3-methylbenzamide.

Molecular Properties

Compound NameN-(2,4-dimethoxyphenyl)-3-methylbenzamide
PubChem CID710450
Molecular FormulaC16H17NO3
Molecular Weight271.32 g/mol
Exact Mass271.12
IUPAC NameN-(2,4-dimethoxyphenyl)-3-methylbenzamide
SMILESCOc1ccc(NC(=O)c2cccc(C)c2)c(OC)c1
InChIInChI=1S/C16H17NO3/c1-11-5-4-6-12(9-11)16(18)17-14-8-7-13(19-2)10-15(14)20-3/h4-10H,1-3H3,(H,17,18)
InChIKeyAEJJFGDHYXSPNW-UHFFFAOYSA-N
XLogP3.26
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2,4-dimethoxyphenyl)carbamothioyl]-3-methylbenzamide
CID 834971
N-(2,4-dimethoxyphenyl)-3-hydroxybenzamide
CID 19256865
3-N-tert-butyl-1-N-(2,4-dimethoxyphenyl)benzene-1,3-dicarboxamide
CID 109056037
N-(2,4-dimethoxyphenyl)-3-(methoxymethyl)benzamide
CID 7603182
3-N-(2,4-dimethoxyphenyl)-1-N-(2-methoxyethyl)benzene-1,3-dicarboxamide
CID 109052609
3-N-cyclohexyl-1-N-(2,4-dimethoxyphenyl)benzene-1,3-dicarboxamide
CID 109052232
N-(2,4-dimethoxyphenyl)-2-methoxypyridine-4-carboxamide
CID 84580517
N-[3-[2-(2,4-dimethoxyanilino)-2-oxo-1-phenylethyl]sulfanylphenyl]-3-methylbenzamide
CID 18906942
3-acetamido-N-(2,4-dimethoxyphenyl)-4-methoxybenzamide
CID 110764309
N-(2,4-dimethoxyphenyl)-4-phenylbenzamide
CID 602380
3-benzamido-N-(2-methoxy-4-methylphenyl)benzamide
CID 5082074
N-(2,4-dimethoxyphenyl)-4-fluorobenzamide
CID 2832276

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dimethoxyphenyl)-3-methylbenzamide?
The IUPAC name of N-(2,4-dimethoxyphenyl)-3-methylbenzamide (CID 710450) is N-(2,4-dimethoxyphenyl)-3-methylbenzamide.
What is the SMILES notation for N-(2,4-dimethoxyphenyl)-3-methylbenzamide?
The canonical SMILES for N-(2,4-dimethoxyphenyl)-3-methylbenzamide is COc1ccc(NC(=O)c2cccc(C)c2)c(OC)c1.
What is the InChIKey of N-(2,4-dimethoxyphenyl)-3-methylbenzamide?
The InChIKey is AEJJFGDHYXSPNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17NO3/c1-11-5-4-6-12(9-11)16(18)17-14-8-7-13(19-2)10-15(14)20-3/h4-10H,1-3H3,(H,17,18).
What are the key properties of N-(2,4-dimethoxyphenyl)-3-methylbenzamide?
N-(2,4-dimethoxyphenyl)-3-methylbenzamide has a molecular weight of 271.32 g/mol, XLogP of 3.26, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dimethoxyphenyl)-3-methylbenzamide is sourced from PubChem (CID 710450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).