1-(3,3-dimethylcyclopentyl)-3-(propylamino)pyrrolidin-2-one

C14H26N2O — CID 114541375

IUPAC1-(3,3-dimethylcyclopentyl)-3-(propylamino)pyrrolidin-2-one
SMILESCCCNC1CCN(C2CCC(C)(C)C2)C1=O
InChIInChI=1S/C14H26N2O/c1-4-8-15-12-6-9-16(13(12)17)11-5-7-14(2,3)10-11/h11-12,15H,4-10H2,1-3H3
InChIKeyRIHSULZINIRKSC-UHFFFAOYSA-N
MW238.37 g/mol
LogP2.17
Rot. Bonds4

About 1-(3,3-dimethylcyclopentyl)-3-(propylamino)pyrrolidin-2-one

1-(3,3-dimethylcyclopentyl)-3-(propylamino)pyrrolidin-2-one (PubChem CID 114541375) has the molecular formula C14H26N2O and a molecular weight of 238.37 g/mol. Its IUPAC name is 1-(3,3-dimethylcyclopentyl)-3-(propylamino)pyrrolidin-2-one.

Molecular Properties

Compound Name1-(3,3-dimethylcyclopentyl)-3-(propylamino)pyrrolidin-2-one
PubChem CID114541375
Molecular FormulaC14H26N2O
Molecular Weight238.37 g/mol
Exact Mass238.20
IUPAC Name1-(3,3-dimethylcyclopentyl)-3-(propylamino)pyrrolidin-2-one
SMILESCCCNC1CCN(C2CCC(C)(C)C2)C1=O
InChIInChI=1S/C14H26N2O/c1-4-8-15-12-6-9-16(13(12)17)11-5-7-14(2,3)10-11/h11-12,15H,4-10H2,1-3H3
InChIKeyRIHSULZINIRKSC-UHFFFAOYSA-N
XLogP2.17
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.37
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-bromo-1-(3,3-dimethylcyclopentyl)piperidin-2-one
CID 114541337
1-[(1-methylcyclopentyl)methyl]-3-(propylamino)pyrrolidin-2-one
CID 55261019
3-(3,3-dimethylcyclopentyl)-5-methylimidazolidin-4-one
CID 114552415
1-(3-ethylcyclohexyl)-3-(propylamino)piperidin-2-one
CID 64747797
3-butan-2-yl-1-(3,3-dimethylcyclopentyl)-1,4-diazepane-2,5-dione
CID 114551444
1-(1,1-dioxothian-4-yl)-3-(ethylamino)pyrrolidin-2-one
CID 54972965
3,3-dimethyl-N-propylcyclopentan-1-amine
CID 20709207
1-(cyclohexylmethyl)-3-(propylamino)pyrrolidin-2-one
CID 54972766
3-(ethylamino)-1-hexan-3-ylpyrrolidin-2-one
CID 62119682
1-(1-hydroxy-3-methoxypropan-2-yl)-3-(propylamino)pyrrolidin-2-one
CID 106187223
1-(2-ethylphenyl)-3-(propylamino)pyrrolidin-2-one
CID 54973363
3-(ethylamino)-1-(1-ethylpiperidin-3-yl)pyrrolidin-2-one
CID 54972827

Frequently Asked Questions

What is the IUPAC name of 1-(3,3-dimethylcyclopentyl)-3-(propylamino)pyrrolidin-2-one?
The IUPAC name of 1-(3,3-dimethylcyclopentyl)-3-(propylamino)pyrrolidin-2-one (CID 114541375) is 1-(3,3-dimethylcyclopentyl)-3-(propylamino)pyrrolidin-2-one.
What is the SMILES notation for 1-(3,3-dimethylcyclopentyl)-3-(propylamino)pyrrolidin-2-one?
The canonical SMILES for 1-(3,3-dimethylcyclopentyl)-3-(propylamino)pyrrolidin-2-one is CCCNC1CCN(C2CCC(C)(C)C2)C1=O.
What is the InChIKey of 1-(3,3-dimethylcyclopentyl)-3-(propylamino)pyrrolidin-2-one?
The InChIKey is RIHSULZINIRKSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O/c1-4-8-15-12-6-9-16(13(12)17)11-5-7-14(2,3)10-11/h11-12,15H,4-10H2,1-3H3.
What are the key properties of 1-(3,3-dimethylcyclopentyl)-3-(propylamino)pyrrolidin-2-one?
1-(3,3-dimethylcyclopentyl)-3-(propylamino)pyrrolidin-2-one has a molecular weight of 238.37 g/mol, XLogP of 2.17, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,3-dimethylcyclopentyl)-3-(propylamino)pyrrolidin-2-one is sourced from PubChem (CID 114541375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).