(1-aminocyclopentyl)-(2-methyl-3-phenylpyrrolidin-1-yl)methanone

C17H24N2O — CID 119337122

IUPAC(1-aminocyclopentyl)-(2-methyl-3-phenylpyrrolidin-1-yl)methanone
SMILESCC1C(c2ccccc2)CCN1C(=O)C1(N)CCCC1
InChIInChI=1S/C17H24N2O/c1-13-15(14-7-3-2-4-8-14)9-12-19(13)16(20)17(18)10-5-6-11-17/h2-4,7-8,13,15H,5-6,9-12,18H2,1H3
InChIKeyPCPDZOUUOJEPHC-UHFFFAOYSA-N
MW272.39 g/mol
LogP2.66
Rot. Bonds2

About (1-aminocyclopentyl)-(2-methyl-3-phenylpyrrolidin-1-yl)methanone

(1-aminocyclopentyl)-(2-methyl-3-phenylpyrrolidin-1-yl)methanone (PubChem CID 119337122) has the molecular formula C17H24N2O and a molecular weight of 272.39 g/mol. Its IUPAC name is (1-aminocyclopentyl)-(2-methyl-3-phenylpyrrolidin-1-yl)methanone.

Molecular Properties

Compound Name(1-aminocyclopentyl)-(2-methyl-3-phenylpyrrolidin-1-yl)methanone
PubChem CID119337122
Molecular FormulaC17H24N2O
Molecular Weight272.39 g/mol
Exact Mass272.19
IUPAC Name(1-aminocyclopentyl)-(2-methyl-3-phenylpyrrolidin-1-yl)methanone
SMILESCC1C(c2ccccc2)CCN1C(=O)C1(N)CCCC1
InChIInChI=1S/C17H24N2O/c1-13-15(14-7-3-2-4-8-14)9-12-19(13)16(20)17(18)10-5-6-11-17/h2-4,7-8,13,15H,5-6,9-12,18H2,1H3
InChIKeyPCPDZOUUOJEPHC-UHFFFAOYSA-N
XLogP2.66
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.39
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(4-methoxypiperidin-4-yl)-(2-methyl-3-phenylpyrrolidin-1-yl)methanone
CID 119807354
(1-aminocyclopentyl)-(4-phenylpiperidin-1-yl)methanone;hydrochloride
CID 119278406
(1-aminocyclopentyl)-(4-phenylazepan-1-yl)methanone;hydrochloride
CID 119316131
[(1S,3R)-3-aminocyclohexyl]-[(2R,3S)-2-methyl-3-phenylpyrrolidin-1-yl]methanone
CID 125135133
(1-aminocyclopropyl)-(2-methyl-4-phenylpyrrolidin-1-yl)methanone;hydrochloride
CID 119790908
(3-aminocyclopentyl)-(2-methyl-3-phenylpyrrolidin-1-yl)methanone;hydrochloride
CID 119807327
(2-methyl-3-phenylpyrrolidin-1-yl)-piperidin-3-ylmethanone
CID 119337130
6-(2-methyl-3-phenylpyrrolidine-1-carbonyl)pyridine-2-carboxylic acid
CID 119186871
(1-aminocyclopropyl)-(4-phenylazepan-1-yl)methanone
CID 119770810
(3-chlorophenyl)-[(2S,3R)-2-methyl-3-phenylpyrrolidin-1-yl]methanone
CID 95974609
(2-methyl-3-phenylpyrrolidin-1-yl)-pyridin-3-ylmethanone
CID 110868702
(3R)-2-(1-aminocyclobutanecarbonyl)-3,4-dihydro-1H-isoquinoline-3-carboxylic acid
CID 81172948

Frequently Asked Questions

What is the IUPAC name of (1-aminocyclopentyl)-(2-methyl-3-phenylpyrrolidin-1-yl)methanone?
The IUPAC name of (1-aminocyclopentyl)-(2-methyl-3-phenylpyrrolidin-1-yl)methanone (CID 119337122) is (1-aminocyclopentyl)-(2-methyl-3-phenylpyrrolidin-1-yl)methanone.
What is the SMILES notation for (1-aminocyclopentyl)-(2-methyl-3-phenylpyrrolidin-1-yl)methanone?
The canonical SMILES for (1-aminocyclopentyl)-(2-methyl-3-phenylpyrrolidin-1-yl)methanone is CC1C(c2ccccc2)CCN1C(=O)C1(N)CCCC1.
What is the InChIKey of (1-aminocyclopentyl)-(2-methyl-3-phenylpyrrolidin-1-yl)methanone?
The InChIKey is PCPDZOUUOJEPHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O/c1-13-15(14-7-3-2-4-8-14)9-12-19(13)16(20)17(18)10-5-6-11-17/h2-4,7-8,13,15H,5-6,9-12,18H2,1H3.
What are the key properties of (1-aminocyclopentyl)-(2-methyl-3-phenylpyrrolidin-1-yl)methanone?
(1-aminocyclopentyl)-(2-methyl-3-phenylpyrrolidin-1-yl)methanone has a molecular weight of 272.39 g/mol, XLogP of 2.66, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1-aminocyclopentyl)-(2-methyl-3-phenylpyrrolidin-1-yl)methanone is sourced from PubChem (CID 119337122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).