(2-cyclopentylpyrrolidin-1-yl)-(6-fluoro-3-pyridinyl)methanone

C15H19FN2O — CID 63978793

IUPAC(2-cyclopentylpyrrolidin-1-yl)-(6-fluoro-3-pyridinyl)methanone
SMILESO=C(c1ccc(F)nc1)N1CCCC1C1CCCC1
InChIInChI=1S/C15H19FN2O/c16-14-8-7-12(10-17-14)15(19)18-9-3-6-13(18)11-4-1-2-5-11/h7-8,10-11,13H,1-6,9H2
InChIKeyUMVIEYYMSUAYKH-UHFFFAOYSA-N
MW262.33 g/mol
LogP3.02
Rot. Bonds2

About (2-cyclopentylpyrrolidin-1-yl)-(6-fluoro-3-pyridinyl)methanone

(2-cyclopentylpyrrolidin-1-yl)-(6-fluoro-3-pyridinyl)methanone (PubChem CID 63978793) has the molecular formula C15H19FN2O and a molecular weight of 262.33 g/mol. Its IUPAC name is (2-cyclopentylpyrrolidin-1-yl)-(6-fluoro-3-pyridinyl)methanone.

Molecular Properties

Compound Name(2-cyclopentylpyrrolidin-1-yl)-(6-fluoro-3-pyridinyl)methanone
PubChem CID63978793
Molecular FormulaC15H19FN2O
Molecular Weight262.33 g/mol
Exact Mass262.15
IUPAC Name(2-cyclopentylpyrrolidin-1-yl)-(6-fluoro-3-pyridinyl)methanone
SMILESO=C(c1ccc(F)nc1)N1CCCC1C1CCCC1
InChIInChI=1S/C15H19FN2O/c16-14-8-7-12(10-17-14)15(19)18-9-3-6-13(18)11-4-1-2-5-11/h7-8,10-11,13H,1-6,9H2
InChIKeyUMVIEYYMSUAYKH-UHFFFAOYSA-N
XLogP3.02
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.33
LogP ≤ 53.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

(2-cyclohexylpyrrolidin-1-yl)-(6-fluoro-3-pyridinyl)methanone
CID 63979551
(6-fluoro-3-pyridinyl)-(2-iodopiperidin-1-yl)methanone
CID 68880844
1-(6-fluoropyridine-3-carbonyl)pyrrolidine-2-carboxamide
CID 63972948
N-[5-[(4aR,8aS)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinoline-1-carbonyl]-2-pyridinyl]-4-fluorobenzamide
CID 58707812
(2-ethylpyrrolidin-1-yl)-(6-fluoro-3-pyridinyl)methanone
CID 63971232
(2-cyclopropylpyrrolidin-1-yl)-(4-fluorophenyl)methanone
CID 110871773
N-cyclopropyl-1-(6-fluoropyridine-3-carbonyl)pyrrolidine-2-carboxamide
CID 63979920
1-(6-fluoropyridine-3-carbonyl)-N-methylpiperidine-2-carboxamide
CID 63978579
(2-cyclopentylpyrrolidin-1-yl)-(4-fluoro-3-sulfanylphenyl)methanone
CID 107027342
1-[4-[(2S)-2-cyclopentylpyrrolidine-1-carbonyl]phenyl]ethanone
CID 95334900
3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl(pyridin-4-yl)methanone
CID 42892856
[(4aS,8aS)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]-(4-aminophenyl)methanone
CID 90935623

Frequently Asked Questions

What is the IUPAC name of (2-cyclopentylpyrrolidin-1-yl)-(6-fluoro-3-pyridinyl)methanone?
The IUPAC name of (2-cyclopentylpyrrolidin-1-yl)-(6-fluoro-3-pyridinyl)methanone (CID 63978793) is (2-cyclopentylpyrrolidin-1-yl)-(6-fluoro-3-pyridinyl)methanone.
What is the SMILES notation for (2-cyclopentylpyrrolidin-1-yl)-(6-fluoro-3-pyridinyl)methanone?
The canonical SMILES for (2-cyclopentylpyrrolidin-1-yl)-(6-fluoro-3-pyridinyl)methanone is O=C(c1ccc(F)nc1)N1CCCC1C1CCCC1.
What is the InChIKey of (2-cyclopentylpyrrolidin-1-yl)-(6-fluoro-3-pyridinyl)methanone?
The InChIKey is UMVIEYYMSUAYKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19FN2O/c16-14-8-7-12(10-17-14)15(19)18-9-3-6-13(18)11-4-1-2-5-11/h7-8,10-11,13H,1-6,9H2.
What are the key properties of (2-cyclopentylpyrrolidin-1-yl)-(6-fluoro-3-pyridinyl)methanone?
(2-cyclopentylpyrrolidin-1-yl)-(6-fluoro-3-pyridinyl)methanone has a molecular weight of 262.33 g/mol, XLogP of 3.02, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-cyclopentylpyrrolidin-1-yl)-(6-fluoro-3-pyridinyl)methanone is sourced from PubChem (CID 63978793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).