N-cyclopentyl-1-phenyl-3-pyridin-3-ylpyrazole-4-carboxamide

C20H20N4O — CID 9208931

IUPACN-cyclopentyl-1-phenyl-3-pyridin-3-ylpyrazole-4-carboxamide
SMILESO=C(NC1CCCC1)c1cn(-c2ccccc2)nc1-c1cccnc1
InChIInChI=1S/C20H20N4O/c25-20(22-16-8-4-5-9-16)18-14-24(17-10-2-1-3-11-17)23-19(18)15-7-6-12-21-13-15/h1-3,6-7,10-14,16H,4-5,8-9H2,(H,22,25)
InChIKeyBDFQDOKYAJHRMF-UHFFFAOYSA-N
MW332.41 g/mol
LogP3.61
Rot. Bonds4

About N-cyclopentyl-1-phenyl-3-pyridin-3-ylpyrazole-4-carboxamide

N-cyclopentyl-1-phenyl-3-pyridin-3-ylpyrazole-4-carboxamide (PubChem CID 9208931) has the molecular formula C20H20N4O and a molecular weight of 332.41 g/mol. Its IUPAC name is N-cyclopentyl-1-phenyl-3-pyridin-3-ylpyrazole-4-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-1-phenyl-3-pyridin-3-ylpyrazole-4-carboxamide
PubChem CID9208931
Molecular FormulaC20H20N4O
Molecular Weight332.41 g/mol
Exact Mass332.16
IUPAC NameN-cyclopentyl-1-phenyl-3-pyridin-3-ylpyrazole-4-carboxamide
SMILESO=C(NC1CCCC1)c1cn(-c2ccccc2)nc1-c1cccnc1
InChIInChI=1S/C20H20N4O/c25-20(22-16-8-4-5-9-16)18-14-24(17-10-2-1-3-11-17)23-19(18)15-7-6-12-21-13-15/h1-3,6-7,10-14,16H,4-5,8-9H2,(H,22,25)
InChIKeyBDFQDOKYAJHRMF-UHFFFAOYSA-N
XLogP3.61
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.41
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-cycloheptyl-1-phenyl-3-pyridin-3-ylpyrazole-4-carboxamide
CID 9268455
N-(4-hydroxycyclohexyl)-1-phenyl-3-pyridin-3-ylpyrazole-4-carboxamide
CID 78767481
N-[4-chloro-3-(cyclohexylcarbamoyl)phenyl]-1-phenyl-3-pyridin-3-ylpyrazole-4-carboxamide
CID 55906395
N-[(3S)-2-oxoazepan-3-yl]-1-phenyl-3-pyridin-3-ylpyrazole-4-carboxamide
CID 94133021
N-(2-oxoazepan-3-yl)-1-phenyl-3-pyridin-3-ylpyrazole-4-carboxamide
CID 71892750
1-phenyl-3-pyridin-3-yl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrazole-4-carboxamide
CID 8001480
4-[(1,3-diphenylpyrazole-4-carbonyl)amino]cyclohexane-1-carboxylic acid
CID 119229120
N-[4-(cyclopentylmethylamino)phenyl]-1-phenyl-3-pyridin-3-ylpyrazole-4-carboxamide
CID 56533831
N-[1-(cyclopropanecarbonyl)piperidin-4-yl]-1,3-diphenylpyrazole-4-carboxamide
CID 46540299
1-phenyl-3-pyridin-3-ylpyrazole-4-carboxamide
CID 883433
1-benzyl-N-cyclopropyl-3-pyridin-3-ylpyrazole-4-carboxamide
CID 9461304
N-(4,5-dihydro-1,3-thiazol-2-yl)-1-phenyl-3-pyridin-3-ylpyrazole-4-carboxamide
CID 4963802

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-1-phenyl-3-pyridin-3-ylpyrazole-4-carboxamide?
The IUPAC name of N-cyclopentyl-1-phenyl-3-pyridin-3-ylpyrazole-4-carboxamide (CID 9208931) is N-cyclopentyl-1-phenyl-3-pyridin-3-ylpyrazole-4-carboxamide.
What is the SMILES notation for N-cyclopentyl-1-phenyl-3-pyridin-3-ylpyrazole-4-carboxamide?
The canonical SMILES for N-cyclopentyl-1-phenyl-3-pyridin-3-ylpyrazole-4-carboxamide is O=C(NC1CCCC1)c1cn(-c2ccccc2)nc1-c1cccnc1.
What is the InChIKey of N-cyclopentyl-1-phenyl-3-pyridin-3-ylpyrazole-4-carboxamide?
The InChIKey is BDFQDOKYAJHRMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N4O/c25-20(22-16-8-4-5-9-16)18-14-24(17-10-2-1-3-11-17)23-19(18)15-7-6-12-21-13-15/h1-3,6-7,10-14,16H,4-5,8-9H2,(H,22,25).
What are the key properties of N-cyclopentyl-1-phenyl-3-pyridin-3-ylpyrazole-4-carboxamide?
N-cyclopentyl-1-phenyl-3-pyridin-3-ylpyrazole-4-carboxamide has a molecular weight of 332.41 g/mol, XLogP of 3.61, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-1-phenyl-3-pyridin-3-ylpyrazole-4-carboxamide is sourced from PubChem (CID 9208931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).