3-[(3-methoxybenzoyl)amino]-N-(2-methylpropyl)benzamide

C19H22N2O3 — CID 763472

IUPAC3-[(3-methoxybenzoyl)amino]-N-(2-methylpropyl)benzamide
SMILESCOc1cccc(C(=O)Nc2cccc(C(=O)NCC(C)C)c2)c1
InChIInChI=1S/C19H22N2O3/c1-13(2)12-20-18(22)14-6-4-8-16(10-14)21-19(23)15-7-5-9-17(11-15)24-3/h4-11,13H,12H2,1-3H3,(H,20,22)(H,21,23)
InChIKeyIQIDDKKIBSGHIW-UHFFFAOYSA-N
MW326.40 g/mol
LogP3.33
Rot. Bonds6

About 3-[(3-methoxybenzoyl)amino]-N-(2-methylpropyl)benzamide

3-[(3-methoxybenzoyl)amino]-N-(2-methylpropyl)benzamide (PubChem CID 763472) has the molecular formula C19H22N2O3 and a molecular weight of 326.40 g/mol. Its IUPAC name is 3-[(3-methoxybenzoyl)amino]-N-(2-methylpropyl)benzamide.

Molecular Properties

Compound Name3-[(3-methoxybenzoyl)amino]-N-(2-methylpropyl)benzamide
PubChem CID763472
Molecular FormulaC19H22N2O3
Molecular Weight326.40 g/mol
Exact Mass326.16
IUPAC Name3-[(3-methoxybenzoyl)amino]-N-(2-methylpropyl)benzamide
SMILESCOc1cccc(C(=O)Nc2cccc(C(=O)NCC(C)C)c2)c1
InChIInChI=1S/C19H22N2O3/c1-13(2)12-20-18(22)14-6-4-8-16(10-14)21-19(23)15-7-5-9-17(11-15)24-3/h4-11,13H,12H2,1-3H3,(H,20,22)(H,21,23)
InChIKeyIQIDDKKIBSGHIW-UHFFFAOYSA-N
XLogP3.33
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 53.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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4'-Methoxy-3-nitrobenzanilide
CID 306529
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N-(2-(4-(4-Chlorophenyl)piperazin-1-yl)ethyl)-3-methoxybenzamide
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CID 139031
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CID 531845

Frequently Asked Questions

What is the IUPAC name of 3-[(3-methoxybenzoyl)amino]-N-(2-methylpropyl)benzamide?
The IUPAC name of 3-[(3-methoxybenzoyl)amino]-N-(2-methylpropyl)benzamide (CID 763472) is 3-[(3-methoxybenzoyl)amino]-N-(2-methylpropyl)benzamide.
What is the SMILES notation for 3-[(3-methoxybenzoyl)amino]-N-(2-methylpropyl)benzamide?
The canonical SMILES for 3-[(3-methoxybenzoyl)amino]-N-(2-methylpropyl)benzamide is COc1cccc(C(=O)Nc2cccc(C(=O)NCC(C)C)c2)c1.
What is the InChIKey of 3-[(3-methoxybenzoyl)amino]-N-(2-methylpropyl)benzamide?
The InChIKey is IQIDDKKIBSGHIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O3/c1-13(2)12-20-18(22)14-6-4-8-16(10-14)21-19(23)15-7-5-9-17(11-15)24-3/h4-11,13H,12H2,1-3H3,(H,20,22)(H,21,23).
What are the key properties of 3-[(3-methoxybenzoyl)amino]-N-(2-methylpropyl)benzamide?
3-[(3-methoxybenzoyl)amino]-N-(2-methylpropyl)benzamide has a molecular weight of 326.40 g/mol, XLogP of 3.33, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(3-methoxybenzoyl)amino]-N-(2-methylpropyl)benzamide is sourced from PubChem (CID 763472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).