(2-cyclopentylpyrrolidin-1-yl)-(1H-pyrazol-4-yl)methanone

C13H19N3O — CID 61149834

IUPAC(2-cyclopentylpyrrolidin-1-yl)-(1H-pyrazol-4-yl)methanone
SMILESO=C(c1cn[nH]c1)N1CCCC1C1CCCC1
InChIInChI=1S/C13H19N3O/c17-13(11-8-14-15-9-11)16-7-3-6-12(16)10-4-1-2-5-10/h8-10,12H,1-7H2,(H,14,15)
InChIKeyUVZZYTYYWBLJSG-UHFFFAOYSA-N
MW233.31 g/mol
LogP2.20
Rot. Bonds2

About (2-cyclopentylpyrrolidin-1-yl)-(1H-pyrazol-4-yl)methanone

(2-cyclopentylpyrrolidin-1-yl)-(1H-pyrazol-4-yl)methanone (PubChem CID 61149834) has the molecular formula C13H19N3O and a molecular weight of 233.31 g/mol. Its IUPAC name is (2-cyclopentylpyrrolidin-1-yl)-(1H-pyrazol-4-yl)methanone.

Molecular Properties

Compound Name(2-cyclopentylpyrrolidin-1-yl)-(1H-pyrazol-4-yl)methanone
PubChem CID61149834
Molecular FormulaC13H19N3O
Molecular Weight233.31 g/mol
Exact Mass233.15
IUPAC Name(2-cyclopentylpyrrolidin-1-yl)-(1H-pyrazol-4-yl)methanone
SMILESO=C(c1cn[nH]c1)N1CCCC1C1CCCC1
InChIInChI=1S/C13H19N3O/c17-13(11-8-14-15-9-11)16-7-3-6-12(16)10-4-1-2-5-10/h8-10,12H,1-7H2,(H,14,15)
InChIKeyUVZZYTYYWBLJSG-UHFFFAOYSA-N
XLogP2.20
TPSA48.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(1H-Pyrazol-4-yl)(pyrrolidin-1-yl)methanone
CID 43582286
[9-(2,2-dimethylpropyl)-2,9-diazaspiro[4.5]decan-2-yl]-(1H-pyrazol-4-yl)methanone
CID 45239009
N-methyl-4-[1-(1H-pyrazol-4-ylcarbonyl)tetrahydro-1H-pyrrol-3-yl]tetrahydro-1(2H)-pyridinecarboxamide
CID 91921353
N-{[1-(dimethylamino)cyclohexyl]methyl}-1H-pyrazole-4-carboxamide
CID 61249302
1-[[(3R)-1-(1H-pyrazole-4-carbonyl)piperidin-3-yl]methyl]pyrrolidin-2-one
CID 99948671
2-(1H-pyrazol-4-ylcarbonyl)-2-azaspiro[4.4]nonane
CID 124205376
N-(cyclohexylmethyl)-1H-pyrazole-4-carboxamide
CID 6734414
N-[4-(trifluoromethyl)cyclohexyl]-1H-pyrazole-4-carboxamide
CID 60785978
N-[3-(trifluoromethyl)cyclohexyl]-1H-pyrazole-4-carboxamide
CID 60788329
N-[2-(trifluoromethyl)cyclohexyl]-1H-pyrazole-4-carboxamide
CID 61258478
N-(1-cyclopentyl-2,2,2-trifluoroethyl)-1H-pyrazole-4-carboxamide
CID 122150161
N-[(1S)-1-cyclopentyl-2,2,2-trifluoroethyl]-1H-pyrazole-4-carboxamide
CID 124608848

Frequently Asked Questions

What is the IUPAC name of (2-cyclopentylpyrrolidin-1-yl)-(1H-pyrazol-4-yl)methanone?
The IUPAC name of (2-cyclopentylpyrrolidin-1-yl)-(1H-pyrazol-4-yl)methanone (CID 61149834) is (2-cyclopentylpyrrolidin-1-yl)-(1H-pyrazol-4-yl)methanone.
What is the SMILES notation for (2-cyclopentylpyrrolidin-1-yl)-(1H-pyrazol-4-yl)methanone?
The canonical SMILES for (2-cyclopentylpyrrolidin-1-yl)-(1H-pyrazol-4-yl)methanone is O=C(c1cn[nH]c1)N1CCCC1C1CCCC1.
What is the InChIKey of (2-cyclopentylpyrrolidin-1-yl)-(1H-pyrazol-4-yl)methanone?
The InChIKey is UVZZYTYYWBLJSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O/c17-13(11-8-14-15-9-11)16-7-3-6-12(16)10-4-1-2-5-10/h8-10,12H,1-7H2,(H,14,15).
What are the key properties of (2-cyclopentylpyrrolidin-1-yl)-(1H-pyrazol-4-yl)methanone?
(2-cyclopentylpyrrolidin-1-yl)-(1H-pyrazol-4-yl)methanone has a molecular weight of 233.31 g/mol, XLogP of 2.20, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-cyclopentylpyrrolidin-1-yl)-(1H-pyrazol-4-yl)methanone is sourced from PubChem (CID 61149834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).