2-cyclopentyl-1-[3-(4-methyl-1H-pyrazol-5-yl)pyrrolidin-1-yl]ethanone

C15H23N3O — CID 110270853

IUPAC2-cyclopentyl-1-[3-(4-methyl-1H-pyrazol-5-yl)pyrrolidin-1-yl]ethanone
SMILESCc1cn[nH]c1C1CCN(C(=O)CC2CCCC2)C1
InChIInChI=1S/C15H23N3O/c1-11-9-16-17-15(11)13-6-7-18(10-13)14(19)8-12-4-2-3-5-12/h9,12-13H,2-8,10H2,1H3,(H,16,17)
InChIKeyOSIJGEIXGHVGBL-UHFFFAOYSA-N
MW261.37 g/mol
LogP2.61
Rot. Bonds3

About 2-cyclopentyl-1-[3-(4-methyl-1H-pyrazol-5-yl)pyrrolidin-1-yl]ethanone

2-cyclopentyl-1-[3-(4-methyl-1H-pyrazol-5-yl)pyrrolidin-1-yl]ethanone (PubChem CID 110270853) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is 2-cyclopentyl-1-[3-(4-methyl-1H-pyrazol-5-yl)pyrrolidin-1-yl]ethanone.

Molecular Properties

Compound Name2-cyclopentyl-1-[3-(4-methyl-1H-pyrazol-5-yl)pyrrolidin-1-yl]ethanone
PubChem CID110270853
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC Name2-cyclopentyl-1-[3-(4-methyl-1H-pyrazol-5-yl)pyrrolidin-1-yl]ethanone
SMILESCc1cn[nH]c1C1CCN(C(=O)CC2CCCC2)C1
InChIInChI=1S/C15H23N3O/c1-11-9-16-17-15(11)13-6-7-18(10-13)14(19)8-12-4-2-3-5-12/h9,12-13H,2-8,10H2,1H3,(H,16,17)
InChIKeyOSIJGEIXGHVGBL-UHFFFAOYSA-N
XLogP2.61
TPSA48.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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3-methoxy-1-[3-(4-methyl-1H-pyrazol-5-yl)piperidin-1-yl]propan-1-one
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cyclopentyl-[3-(4-methyl-1H-pyrazol-5-yl)pyrrolidin-1-yl]methanone
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3-amino-N-[3-(5-methyl-1H-pyrazol-4-yl)propyl]propanamide
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3-(4,5-dimethyl-1H-pyrazol-3-yl)-1-[(2S)-2-propan-2-yl-2,5-dihydropyrrol-1-yl]propan-1-one
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Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-1-[3-(4-methyl-1H-pyrazol-5-yl)pyrrolidin-1-yl]ethanone?
The IUPAC name of 2-cyclopentyl-1-[3-(4-methyl-1H-pyrazol-5-yl)pyrrolidin-1-yl]ethanone (CID 110270853) is 2-cyclopentyl-1-[3-(4-methyl-1H-pyrazol-5-yl)pyrrolidin-1-yl]ethanone.
What is the SMILES notation for 2-cyclopentyl-1-[3-(4-methyl-1H-pyrazol-5-yl)pyrrolidin-1-yl]ethanone?
The canonical SMILES for 2-cyclopentyl-1-[3-(4-methyl-1H-pyrazol-5-yl)pyrrolidin-1-yl]ethanone is Cc1cn[nH]c1C1CCN(C(=O)CC2CCCC2)C1.
What is the InChIKey of 2-cyclopentyl-1-[3-(4-methyl-1H-pyrazol-5-yl)pyrrolidin-1-yl]ethanone?
The InChIKey is OSIJGEIXGHVGBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-11-9-16-17-15(11)13-6-7-18(10-13)14(19)8-12-4-2-3-5-12/h9,12-13H,2-8,10H2,1H3,(H,16,17).
What are the key properties of 2-cyclopentyl-1-[3-(4-methyl-1H-pyrazol-5-yl)pyrrolidin-1-yl]ethanone?
2-cyclopentyl-1-[3-(4-methyl-1H-pyrazol-5-yl)pyrrolidin-1-yl]ethanone has a molecular weight of 261.37 g/mol, XLogP of 2.61, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-1-[3-(4-methyl-1H-pyrazol-5-yl)pyrrolidin-1-yl]ethanone is sourced from PubChem (CID 110270853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).