1-(2,2-dimethylcyclopentyl)-3-(propan-2-ylamino)piperidin-2-one

C15H28N2O — CID 79877894

IUPAC1-(2,2-dimethylcyclopentyl)-3-(propan-2-ylamino)piperidin-2-one
SMILESCC(C)NC1CCCN(C2CCCC2(C)C)C1=O
InChIInChI=1S/C15H28N2O/c1-11(2)16-12-7-6-10-17(14(12)18)13-8-5-9-15(13,3)4/h11-13,16H,5-10H2,1-4H3
InChIKeyWXMVNTJJRRLTMX-UHFFFAOYSA-N
MW252.40 g/mol
LogP2.55
Rot. Bonds3

About 1-(2,2-dimethylcyclopentyl)-3-(propan-2-ylamino)piperidin-2-one

1-(2,2-dimethylcyclopentyl)-3-(propan-2-ylamino)piperidin-2-one (PubChem CID 79877894) has the molecular formula C15H28N2O and a molecular weight of 252.40 g/mol. Its IUPAC name is 1-(2,2-dimethylcyclopentyl)-3-(propan-2-ylamino)piperidin-2-one.

Molecular Properties

Compound Name1-(2,2-dimethylcyclopentyl)-3-(propan-2-ylamino)piperidin-2-one
PubChem CID79877894
Molecular FormulaC15H28N2O
Molecular Weight252.40 g/mol
Exact Mass252.22
IUPAC Name1-(2,2-dimethylcyclopentyl)-3-(propan-2-ylamino)piperidin-2-one
SMILESCC(C)NC1CCCN(C2CCCC2(C)C)C1=O
InChIInChI=1S/C15H28N2O/c1-11(2)16-12-7-6-10-17(14(12)18)13-8-5-9-15(13,3)4/h11-13,16H,5-10H2,1-4H3
InChIKeyWXMVNTJJRRLTMX-UHFFFAOYSA-N
XLogP2.55
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.40
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-bromo-1-(2,2-dimethylcyclohexyl)piperidin-2-one
CID 79877891
3-(propan-2-ylamino)-1-(2,2,3,3-tetramethylcyclopropyl)pyrrolidin-2-one
CID 79350265
1-(7-oxabicyclo[2.2.1]heptan-2-yl)-3-(propan-2-ylamino)piperidin-2-one
CID 80733102
3-(propan-2-ylamino)-1-[1-(trifluoromethyl)cyclopropyl]piperidin-2-one
CID 106211601
1-[(1-hydroxy-3-methylcyclohexyl)methyl]-3-(propan-2-ylamino)piperidin-2-one
CID 65118942
1-but-3-yn-2-yl-3-(propan-2-ylamino)piperidin-2-one
CID 114420364
1-(2,3-dihydro-1H-inden-2-yl)-3-(propan-2-ylamino)pyrrolidin-2-one
CID 107849741
1-(2-hydroxy-3-methylbutyl)-3-(propan-2-ylamino)piperidin-2-one
CID 113493057
3-methyl-3-[2-oxo-3-(propan-2-ylamino)piperidin-1-yl]butanamide
CID 106098557
1-(2,2-dimethylcyclohexyl)pyrrolidin-2-imine
CID 79871416
1-(2,2-dimethylcyclopentyl)pyrrole-2,5-dione
CID 79870484
1-(1-hydroxy-4-methylpentan-3-yl)-3-(propan-2-ylamino)piperidin-2-one
CID 114178303

Frequently Asked Questions

What is the IUPAC name of 1-(2,2-dimethylcyclopentyl)-3-(propan-2-ylamino)piperidin-2-one?
The IUPAC name of 1-(2,2-dimethylcyclopentyl)-3-(propan-2-ylamino)piperidin-2-one (CID 79877894) is 1-(2,2-dimethylcyclopentyl)-3-(propan-2-ylamino)piperidin-2-one.
What is the SMILES notation for 1-(2,2-dimethylcyclopentyl)-3-(propan-2-ylamino)piperidin-2-one?
The canonical SMILES for 1-(2,2-dimethylcyclopentyl)-3-(propan-2-ylamino)piperidin-2-one is CC(C)NC1CCCN(C2CCCC2(C)C)C1=O.
What is the InChIKey of 1-(2,2-dimethylcyclopentyl)-3-(propan-2-ylamino)piperidin-2-one?
The InChIKey is WXMVNTJJRRLTMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O/c1-11(2)16-12-7-6-10-17(14(12)18)13-8-5-9-15(13,3)4/h11-13,16H,5-10H2,1-4H3.
What are the key properties of 1-(2,2-dimethylcyclopentyl)-3-(propan-2-ylamino)piperidin-2-one?
1-(2,2-dimethylcyclopentyl)-3-(propan-2-ylamino)piperidin-2-one has a molecular weight of 252.40 g/mol, XLogP of 2.55, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,2-dimethylcyclopentyl)-3-(propan-2-ylamino)piperidin-2-one is sourced from PubChem (CID 79877894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).