(3-amino-2-pyridinyl)-(2-cyclopentylpyrrolidin-1-yl)methanone

C15H21N3O — CID 104742142

IUPAC(3-amino-2-pyridinyl)-(2-cyclopentylpyrrolidin-1-yl)methanone
SMILESNc1cccnc1C(=O)N1CCCC1C1CCCC1
InChIInChI=1S/C15H21N3O/c16-12-7-3-9-17-14(12)15(19)18-10-4-8-13(18)11-5-1-2-6-11/h3,7,9,11,13H,1-2,4-6,8,10,16H2
InChIKeyNMQZECVKLRKHDH-UHFFFAOYSA-N
MW259.35 g/mol
LogP2.46
Rot. Bonds2

About (3-amino-2-pyridinyl)-(2-cyclopentylpyrrolidin-1-yl)methanone

(3-amino-2-pyridinyl)-(2-cyclopentylpyrrolidin-1-yl)methanone (PubChem CID 104742142) has the molecular formula C15H21N3O and a molecular weight of 259.35 g/mol. Its IUPAC name is (3-amino-2-pyridinyl)-(2-cyclopentylpyrrolidin-1-yl)methanone.

Molecular Properties

Compound Name(3-amino-2-pyridinyl)-(2-cyclopentylpyrrolidin-1-yl)methanone
PubChem CID104742142
Molecular FormulaC15H21N3O
Molecular Weight259.35 g/mol
Exact Mass259.17
IUPAC Name(3-amino-2-pyridinyl)-(2-cyclopentylpyrrolidin-1-yl)methanone
SMILESNc1cccnc1C(=O)N1CCCC1C1CCCC1
InChIInChI=1S/C15H21N3O/c16-12-7-3-9-17-14(12)15(19)18-10-4-8-13(18)11-5-1-2-6-11/h3,7,9,11,13H,1-2,4-6,8,10,16H2
InChIKeyNMQZECVKLRKHDH-UHFFFAOYSA-N
XLogP2.46
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.35
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3-amino-2-pyridinyl)-(2-methylazepan-1-yl)methanone
CID 104742375
(3-amino-2-pyridinyl)-[(3S)-3-hydroxypiperidin-1-yl]methanone
CID 107222837
[(4aR,8aR)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]-(3-amino-2-methylphenyl)methanone
CID 102725146
(4-amino-3-pyridinyl)-(2-cyclopentylpyrrolidin-1-yl)methanone
CID 81242396
[(4aS,8aS)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]-(2-pyrimidin-2-yl-1,3-thiazol-4-yl)methanone
CID 94589806
2,3,3a,4,5,6,7,7a-octahydroindol-1-yl-(3-aminothieno[2,3-b]pyridin-2-yl)methanone
CID 82752577
N-[[1-(3-aminopyridine-2-carbonyl)piperidin-2-yl]methyl]methanesulfonamide
CID 104741635
(3-amino-2-pyridinyl)-cyclohexylmethanone
CID 116613694
(2-amino-6-methylphenyl)-(2-cyclohexylpyrrolidin-1-yl)methanone
CID 61110649
[(2S)-2-cyclopentylpyrrolidin-1-yl]-(4-methyl-2-pyrimidin-2-yl-1,3-thiazol-5-yl)methanone
CID 94637457
2,3,3a,4,5,6,7,7a-octahydroindol-1-yl-(2-chloro-3-pyridinyl)methanone
CID 78958423
(3-amino-2-pyridinyl)-[3-(2-hydroxyethyl)piperidin-1-yl]methanone
CID 107216905

Frequently Asked Questions

What is the IUPAC name of (3-amino-2-pyridinyl)-(2-cyclopentylpyrrolidin-1-yl)methanone?
The IUPAC name of (3-amino-2-pyridinyl)-(2-cyclopentylpyrrolidin-1-yl)methanone (CID 104742142) is (3-amino-2-pyridinyl)-(2-cyclopentylpyrrolidin-1-yl)methanone.
What is the SMILES notation for (3-amino-2-pyridinyl)-(2-cyclopentylpyrrolidin-1-yl)methanone?
The canonical SMILES for (3-amino-2-pyridinyl)-(2-cyclopentylpyrrolidin-1-yl)methanone is Nc1cccnc1C(=O)N1CCCC1C1CCCC1.
What is the InChIKey of (3-amino-2-pyridinyl)-(2-cyclopentylpyrrolidin-1-yl)methanone?
The InChIKey is NMQZECVKLRKHDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O/c16-12-7-3-9-17-14(12)15(19)18-10-4-8-13(18)11-5-1-2-6-11/h3,7,9,11,13H,1-2,4-6,8,10,16H2.
What are the key properties of (3-amino-2-pyridinyl)-(2-cyclopentylpyrrolidin-1-yl)methanone?
(3-amino-2-pyridinyl)-(2-cyclopentylpyrrolidin-1-yl)methanone has a molecular weight of 259.35 g/mol, XLogP of 2.46, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-amino-2-pyridinyl)-(2-cyclopentylpyrrolidin-1-yl)methanone is sourced from PubChem (CID 104742142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).