1-cyclopentyl-2-(1-methylpyrazol-4-yl)ethanone

C11H16N2O — CID 62127487

IUPAC1-cyclopentyl-2-(1-methylpyrazol-4-yl)ethanone
SMILESCn1cc(CC(=O)C2CCCC2)cn1
InChIInChI=1S/C11H16N2O/c1-13-8-9(7-12-13)6-11(14)10-4-2-3-5-10/h7-8,10H,2-6H2,1H3
InChIKeyFKWRNBDZHWICAF-UHFFFAOYSA-N
MW192.26 g/mol
LogP1.72
Rot. Bonds3

About 1-cyclopentyl-2-(1-methylpyrazol-4-yl)ethanone

1-cyclopentyl-2-(1-methylpyrazol-4-yl)ethanone (PubChem CID 62127487) has the molecular formula C11H16N2O and a molecular weight of 192.26 g/mol. Its IUPAC name is 1-cyclopentyl-2-(1-methylpyrazol-4-yl)ethanone.

Molecular Properties

Compound Name1-cyclopentyl-2-(1-methylpyrazol-4-yl)ethanone
PubChem CID62127487
Molecular FormulaC11H16N2O
Molecular Weight192.26 g/mol
Exact Mass192.13
IUPAC Name1-cyclopentyl-2-(1-methylpyrazol-4-yl)ethanone
SMILESCn1cc(CC(=O)C2CCCC2)cn1
InChIInChI=1S/C11H16N2O/c1-13-8-9(7-12-13)6-11(14)10-4-2-3-5-10/h7-8,10H,2-6H2,1H3
InChIKeyFKWRNBDZHWICAF-UHFFFAOYSA-N
XLogP1.72
TPSA34.89 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 51.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-cycloheptyl-3-(1-methylpyrazol-4-yl)propan-1-one
CID 103007553
2-(1-methylpyrazol-4-yl)-1-(4-propylcyclohexyl)ethanone
CID 65423483
1-(2,2-dimethylcyclopentyl)-2-(1-methylpyrazol-4-yl)ethanone
CID 107186715
1-(2,2-dimethylcyclopropyl)-2-(1-methylpyrazol-4-yl)ethanone
CID 107003822
2-(1-methylpyrazol-4-yl)-N-propan-2-ylacetamide
CID 130716283
N-methyl-1-[2-(1-methylpyrazol-4-yl)acetyl]piperidine-2-carboxamide
CID 75369149
1-(1-methylpyrazol-4-yl)-4-piperidin-2-ylbutan-2-one
CID 116563728
(2S,3aS,7aS)-1-[2-(1-methylpyrazol-4-yl)acetyl]-2,3,3a,4,5,6,7,7a-octahydroindole-2-carboxylic acid
CID 124829033
(2S,3aR,7aR)-1-[2-(1-methylpyrazol-4-yl)acetyl]-2,3,3a,4,5,6,7,7a-octahydroindole-2-carboxylic acid
CID 124829034
1-(4-tert-butylcyclohexyl)-2-(1-ethylpyrazol-4-yl)ethanone
CID 65401293
1-(5,6-dimethyl-1,4-dithian-2-yl)-2-(1-methylpyrazol-4-yl)ethanone
CID 103344866
2-(1-ethylpyrazol-4-yl)-1-(4-propan-2-ylcyclohexyl)ethanone
CID 65423313

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-2-(1-methylpyrazol-4-yl)ethanone?
The IUPAC name of 1-cyclopentyl-2-(1-methylpyrazol-4-yl)ethanone (CID 62127487) is 1-cyclopentyl-2-(1-methylpyrazol-4-yl)ethanone.
What is the SMILES notation for 1-cyclopentyl-2-(1-methylpyrazol-4-yl)ethanone?
The canonical SMILES for 1-cyclopentyl-2-(1-methylpyrazol-4-yl)ethanone is Cn1cc(CC(=O)C2CCCC2)cn1.
What is the InChIKey of 1-cyclopentyl-2-(1-methylpyrazol-4-yl)ethanone?
The InChIKey is FKWRNBDZHWICAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O/c1-13-8-9(7-12-13)6-11(14)10-4-2-3-5-10/h7-8,10H,2-6H2,1H3.
What are the key properties of 1-cyclopentyl-2-(1-methylpyrazol-4-yl)ethanone?
1-cyclopentyl-2-(1-methylpyrazol-4-yl)ethanone has a molecular weight of 192.26 g/mol, XLogP of 1.72, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-2-(1-methylpyrazol-4-yl)ethanone is sourced from PubChem (CID 62127487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).