2-cyclopentyl-N-[2-(4-methoxyanilino)-2-oxoethyl]-N-methylacetamide

C17H24N2O3 — CID 9438651

IUPAC2-cyclopentyl-N-[2-(4-methoxyanilino)-2-oxoethyl]-N-methylacetamide
SMILESCOc1ccc(NC(=O)CN(C)C(=O)CC2CCCC2)cc1
InChIInChI=1S/C17H24N2O3/c1-19(17(21)11-13-5-3-4-6-13)12-16(20)18-14-7-9-15(22-2)10-8-14/h7-10,13H,3-6,11-12H2,1-2H3,(H,18,20)
InChIKeyPPRYPGJMGRFZRX-UHFFFAOYSA-N
MW304.39 g/mol
LogP2.67
Rot. Bonds6

About 2-cyclopentyl-N-[2-(4-methoxyanilino)-2-oxoethyl]-N-methylacetamide

2-cyclopentyl-N-[2-(4-methoxyanilino)-2-oxoethyl]-N-methylacetamide (PubChem CID 9438651) has the molecular formula C17H24N2O3 and a molecular weight of 304.39 g/mol. Its IUPAC name is 2-cyclopentyl-N-[2-(4-methoxyanilino)-2-oxoethyl]-N-methylacetamide.

Molecular Properties

Compound Name2-cyclopentyl-N-[2-(4-methoxyanilino)-2-oxoethyl]-N-methylacetamide
PubChem CID9438651
Molecular FormulaC17H24N2O3
Molecular Weight304.39 g/mol
Exact Mass304.18
IUPAC Name2-cyclopentyl-N-[2-(4-methoxyanilino)-2-oxoethyl]-N-methylacetamide
SMILESCOc1ccc(NC(=O)CN(C)C(=O)CC2CCCC2)cc1
InChIInChI=1S/C17H24N2O3/c1-19(17(21)11-13-5-3-4-6-13)12-16(20)18-14-7-9-15(22-2)10-8-14/h7-10,13H,3-6,11-12H2,1-2H3,(H,18,20)
InChIKeyPPRYPGJMGRFZRX-UHFFFAOYSA-N
XLogP2.67
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.39
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-cyclopropyl-N-(4-methoxyphenyl)acetamide
CID 3008382
2-[[2-(4-methoxyphenoxy)acetyl]-methylamino]-N-(4-methoxyphenyl)acetamide
CID 7719333
3-[(3aS,7aS)-1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl]-N-[2-(4-methoxyanilino)-2-oxoethyl]-N-methylpropanamide
CID 8501372
N-[2-(4-methoxyanilino)-2-oxoethyl]-N,3-dimethylbutanamide
CID 9438619
3-cyclopentyl-N-(4-methoxyphenyl)propanamide
CID 835546
N-[2-(4-methoxyanilino)-2-oxoethyl]-3-(4-methoxyphenyl)-N-methylpropanamide
CID 7936687
2-cyclopentyl-N-[2-(2,6-dichloroanilino)-2-oxoethyl]-N-methylacetamide
CID 7780171
N-(4-methoxyphenyl)-2-[methyl-[2-(4-methylphenoxy)acetyl]amino]acetamide
CID 9438276
(2R)-N-[2-(4-methoxyanilino)-2-oxoethyl]-N-methyl-5-oxopyrrolidine-2-carboxamide
CID 9438617
N-[3-[[2-(4-methoxyanilino)-2-oxoethyl]-methylamino]-3-oxopropyl]adamantane-1-carboxamide
CID 8620904
2-[cyclopentyl(2-hydroxyethyl)amino]-N-(4-methoxyphenyl)acetamide
CID 60911412
2-[cyclohexyl(2-hydroxypropyl)amino]-N-(4-methoxyphenyl)acetamide
CID 110923589

Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-N-[2-(4-methoxyanilino)-2-oxoethyl]-N-methylacetamide?
The IUPAC name of 2-cyclopentyl-N-[2-(4-methoxyanilino)-2-oxoethyl]-N-methylacetamide (CID 9438651) is 2-cyclopentyl-N-[2-(4-methoxyanilino)-2-oxoethyl]-N-methylacetamide.
What is the SMILES notation for 2-cyclopentyl-N-[2-(4-methoxyanilino)-2-oxoethyl]-N-methylacetamide?
The canonical SMILES for 2-cyclopentyl-N-[2-(4-methoxyanilino)-2-oxoethyl]-N-methylacetamide is COc1ccc(NC(=O)CN(C)C(=O)CC2CCCC2)cc1.
What is the InChIKey of 2-cyclopentyl-N-[2-(4-methoxyanilino)-2-oxoethyl]-N-methylacetamide?
The InChIKey is PPRYPGJMGRFZRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O3/c1-19(17(21)11-13-5-3-4-6-13)12-16(20)18-14-7-9-15(22-2)10-8-14/h7-10,13H,3-6,11-12H2,1-2H3,(H,18,20).
What are the key properties of 2-cyclopentyl-N-[2-(4-methoxyanilino)-2-oxoethyl]-N-methylacetamide?
2-cyclopentyl-N-[2-(4-methoxyanilino)-2-oxoethyl]-N-methylacetamide has a molecular weight of 304.39 g/mol, XLogP of 2.67, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-N-[2-(4-methoxyanilino)-2-oxoethyl]-N-methylacetamide is sourced from PubChem (CID 9438651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).