N-(4-cyclopentylphenyl)-5-oxo-1,4-dihydropyrazole-3-carboxamide

C15H17N3O2 — CID 110467879

IUPACN-(4-cyclopentylphenyl)-5-oxo-1,4-dihydropyrazole-3-carboxamide
SMILESO=C1CC(C(=O)Nc2ccc(C3CCCC3)cc2)=NN1
InChIInChI=1S/C15H17N3O2/c19-14-9-13(17-18-14)15(20)16-12-7-5-11(6-8-12)10-3-1-2-4-10/h5-8,10H,1-4,9H2,(H,16,20)(H,18,19)
InChIKeyBZXUSTOXYCFENQ-UHFFFAOYSA-N
MW271.32 g/mol
LogP2.16
Rot. Bonds3

About N-(4-cyclopentylphenyl)-5-oxo-1,4-dihydropyrazole-3-carboxamide

N-(4-cyclopentylphenyl)-5-oxo-1,4-dihydropyrazole-3-carboxamide (PubChem CID 110467879) has the molecular formula C15H17N3O2 and a molecular weight of 271.32 g/mol. Its IUPAC name is N-(4-cyclopentylphenyl)-5-oxo-1,4-dihydropyrazole-3-carboxamide.

Molecular Properties

Compound NameN-(4-cyclopentylphenyl)-5-oxo-1,4-dihydropyrazole-3-carboxamide
PubChem CID110467879
Molecular FormulaC15H17N3O2
Molecular Weight271.32 g/mol
Exact Mass271.13
IUPAC NameN-(4-cyclopentylphenyl)-5-oxo-1,4-dihydropyrazole-3-carboxamide
SMILESO=C1CC(C(=O)Nc2ccc(C3CCCC3)cc2)=NN1
InChIInChI=1S/C15H17N3O2/c19-14-9-13(17-18-14)15(20)16-12-7-5-11(6-8-12)10-3-1-2-4-10/h5-8,10H,1-4,9H2,(H,16,20)(H,18,19)
InChIKeyBZXUSTOXYCFENQ-UHFFFAOYSA-N
XLogP2.16
TPSA70.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 52.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-oxo-N-pyridin-4-yl-1,4-dihydropyrazole-3-carboxamide
CID 110467687
N-(2-cyclopropylpyrimidin-5-yl)-5-oxo-1,4-dihydropyrazole-3-carboxamide
CID 167766294
N-(4-cyclohexylphenyl)-1H-pyrazole-4-carboxamide
CID 110466735
N-(4-cyclopentylsulfonylphenyl)-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide
CID 110793132
N-(4-cyclohexylphenyl)benzamide
CID 10333838
(4-cyclopentylphenyl)urea
CID 130193151
4-cyclopentyl-N-pyridin-4-ylbenzamide
CID 110464379
N-benzyl-5-oxo-1,4-dihydropyrazole-3-carboxamide
CID 110467706
1-N-(4-cyclohexylphenyl)-4-N-(2H-tetrazol-5-yl)benzene-1,4-dicarboxamide
CID 22501855
N-(4-cyclohexylphenyl)-2-methylpyrazole-3-carboxamide
CID 143736816
2-cyclohexyl-N-(4-cyclohexylphenyl)-4-hydroxy-6-oxo-2,3-dihydro-1H-pyridine-5-carboxamide
CID 54733927
1-cyclohexyl-3-(4-cyclopentylphenyl)urea
CID 170179753

Frequently Asked Questions

What is the IUPAC name of N-(4-cyclopentylphenyl)-5-oxo-1,4-dihydropyrazole-3-carboxamide?
The IUPAC name of N-(4-cyclopentylphenyl)-5-oxo-1,4-dihydropyrazole-3-carboxamide (CID 110467879) is N-(4-cyclopentylphenyl)-5-oxo-1,4-dihydropyrazole-3-carboxamide.
What is the SMILES notation for N-(4-cyclopentylphenyl)-5-oxo-1,4-dihydropyrazole-3-carboxamide?
The canonical SMILES for N-(4-cyclopentylphenyl)-5-oxo-1,4-dihydropyrazole-3-carboxamide is O=C1CC(C(=O)Nc2ccc(C3CCCC3)cc2)=NN1.
What is the InChIKey of N-(4-cyclopentylphenyl)-5-oxo-1,4-dihydropyrazole-3-carboxamide?
The InChIKey is BZXUSTOXYCFENQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O2/c19-14-9-13(17-18-14)15(20)16-12-7-5-11(6-8-12)10-3-1-2-4-10/h5-8,10H,1-4,9H2,(H,16,20)(H,18,19).
What are the key properties of N-(4-cyclopentylphenyl)-5-oxo-1,4-dihydropyrazole-3-carboxamide?
N-(4-cyclopentylphenyl)-5-oxo-1,4-dihydropyrazole-3-carboxamide has a molecular weight of 271.32 g/mol, XLogP of 2.16, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-cyclopentylphenyl)-5-oxo-1,4-dihydropyrazole-3-carboxamide is sourced from PubChem (CID 110467879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).