2-[(3,3-dimethylcyclopentyl)amino]-N-(3-methylphenyl)acetamide

C16H24N2O — CID 114546053

IUPAC2-[(3,3-dimethylcyclopentyl)amino]-N-(3-methylphenyl)acetamide
SMILESCc1cccc(NC(=O)CNC2CCC(C)(C)C2)c1
InChIInChI=1S/C16H24N2O/c1-12-5-4-6-13(9-12)18-15(19)11-17-14-7-8-16(2,3)10-14/h4-6,9,14,17H,7-8,10-11H2,1-3H3,(H,18,19)
InChIKeyMMELZZLWAJVHQW-UHFFFAOYSA-N
MW260.38 g/mol
LogP3.10
Rot. Bonds4

About 2-[(3,3-dimethylcyclopentyl)amino]-N-(3-methylphenyl)acetamide

2-[(3,3-dimethylcyclopentyl)amino]-N-(3-methylphenyl)acetamide (PubChem CID 114546053) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is 2-[(3,3-dimethylcyclopentyl)amino]-N-(3-methylphenyl)acetamide.

Molecular Properties

Compound Name2-[(3,3-dimethylcyclopentyl)amino]-N-(3-methylphenyl)acetamide
PubChem CID114546053
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC Name2-[(3,3-dimethylcyclopentyl)amino]-N-(3-methylphenyl)acetamide
SMILESCc1cccc(NC(=O)CNC2CCC(C)(C)C2)c1
InChIInChI=1S/C16H24N2O/c1-12-5-4-6-13(9-12)18-15(19)11-17-14-7-8-16(2,3)10-14/h4-6,9,14,17H,7-8,10-11H2,1-3H3,(H,18,19)
InChIKeyMMELZZLWAJVHQW-UHFFFAOYSA-N
XLogP3.10
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 53.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(3,3-dimethylcyclohexyl)amino]-N-(3-fluorophenyl)acetamide
CID 81421882
N-(2,6-difluorophenyl)-2-[(3,3-dimethylcyclopentyl)amino]acetamide
CID 114546012
ethyl 4-[[2-(3-methylanilino)-2-oxoethyl]amino]piperidine-1-carboxylate
CID 109003606
2-[(3-ethylcyclohexyl)amino]-N-(3-methylphenyl)acetamide
CID 64742409
N-(3-methylphenyl)-2-[(1-propylpiperidin-4-yl)amino]acetamide
CID 60695688
3,3-dimethyl-N-[2-(3-methylphenyl)ethyl]cyclopentan-1-amine
CID 80705858
2-[(3,3-dimethylcyclopentyl)amino]-N-propan-2-ylacetamide
CID 80692862
2-[[(3R)-3-methyl-1,1-dioxothiolan-3-yl]amino]-N-(3-methylphenyl)acetamide
CID 41411938
2-(2,3-dihydro-1H-inden-1-ylamino)-N-(3-methylphenyl)acetamide
CID 43411225
3,5-dimethyl-N-[2-(3-methylanilino)-2-oxoethyl]benzamide
CID 26537864
N-[2-(3-methylanilino)-2-oxoethyl]benzamide
CID 2968363
N-[3-(carbamoylamino)phenyl]-2-(cyclopropylamino)acetamide
CID 60843404

Frequently Asked Questions

What is the IUPAC name of 2-[(3,3-dimethylcyclopentyl)amino]-N-(3-methylphenyl)acetamide?
The IUPAC name of 2-[(3,3-dimethylcyclopentyl)amino]-N-(3-methylphenyl)acetamide (CID 114546053) is 2-[(3,3-dimethylcyclopentyl)amino]-N-(3-methylphenyl)acetamide.
What is the SMILES notation for 2-[(3,3-dimethylcyclopentyl)amino]-N-(3-methylphenyl)acetamide?
The canonical SMILES for 2-[(3,3-dimethylcyclopentyl)amino]-N-(3-methylphenyl)acetamide is Cc1cccc(NC(=O)CNC2CCC(C)(C)C2)c1.
What is the InChIKey of 2-[(3,3-dimethylcyclopentyl)amino]-N-(3-methylphenyl)acetamide?
The InChIKey is MMELZZLWAJVHQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-12-5-4-6-13(9-12)18-15(19)11-17-14-7-8-16(2,3)10-14/h4-6,9,14,17H,7-8,10-11H2,1-3H3,(H,18,19).
What are the key properties of 2-[(3,3-dimethylcyclopentyl)amino]-N-(3-methylphenyl)acetamide?
2-[(3,3-dimethylcyclopentyl)amino]-N-(3-methylphenyl)acetamide has a molecular weight of 260.38 g/mol, XLogP of 3.10, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3,3-dimethylcyclopentyl)amino]-N-(3-methylphenyl)acetamide is sourced from PubChem (CID 114546053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).