N-cyclopentyl-1-(4-methyl-6-oxo-1H-pyrimidin-2-yl)pyrazole-3-carboxamide

C14H17N5O2 — CID 137049042

IUPACN-cyclopentyl-1-(4-methyl-6-oxo-1H-pyrimidin-2-yl)pyrazole-3-carboxamide
SMILESCc1cc(=O)[nH]c(-n2ccc(C(=O)NC3CCCC3)n2)n1
InChIInChI=1S/C14H17N5O2/c1-9-8-12(20)17-14(15-9)19-7-6-11(18-19)13(21)16-10-4-2-3-5-10/h6-8,10H,2-5H2,1H3,(H,16,21)(H,15,17,20)
InChIKeyDOOQJXMELZCDKG-UHFFFAOYSA-N
MW287.32 g/mol
LogP0.94
Rot. Bonds3

About N-cyclopentyl-1-(4-methyl-6-oxo-1H-pyrimidin-2-yl)pyrazole-3-carboxamide

N-cyclopentyl-1-(4-methyl-6-oxo-1H-pyrimidin-2-yl)pyrazole-3-carboxamide (PubChem CID 137049042) has the molecular formula C14H17N5O2 and a molecular weight of 287.32 g/mol. Its IUPAC name is N-cyclopentyl-1-(4-methyl-6-oxo-1H-pyrimidin-2-yl)pyrazole-3-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-1-(4-methyl-6-oxo-1H-pyrimidin-2-yl)pyrazole-3-carboxamide
PubChem CID137049042
Molecular FormulaC14H17N5O2
Molecular Weight287.32 g/mol
Exact Mass287.14
IUPAC NameN-cyclopentyl-1-(4-methyl-6-oxo-1H-pyrimidin-2-yl)pyrazole-3-carboxamide
SMILESCc1cc(=O)[nH]c(-n2ccc(C(=O)NC3CCCC3)n2)n1
InChIInChI=1S/C14H17N5O2/c1-9-8-12(20)17-14(15-9)19-7-6-11(18-19)13(21)16-10-4-2-3-5-10/h6-8,10H,2-5H2,1H3,(H,16,21)(H,15,17,20)
InChIKeyDOOQJXMELZCDKG-UHFFFAOYSA-N
XLogP0.94
TPSA92.67 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.32
LogP ≤ 50.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[1-(4-methyl-6-oxo-1H-pyrimidin-2-yl)piperidin-4-yl]pyridine-2-carboxamide
CID 136662620
N-cyclopentyl-1-(4-methyl-6-oxo-1H-pyrimidin-2-yl)-5-propan-2-ylpyrazole-4-carboxamide
CID 137049041
N-cyclooctyl-1-(4-fluorophenyl)pyrazole-3-carboxamide
CID 38701604
4-methyl-2-[3-(2-methyl-2,3-dihydroindole-1-carbonyl)pyrazol-1-yl]-1H-pyrimidin-6-one
CID 137049137
(2R)-N-cyclohexyl-2-[(4-methyl-6-oxo-1H-pyrimidin-2-yl)sulfanyl]propanamide
CID 135905211
N-cycloheptyl-1-methyl-5-oxo-4H-1,2,4-triazole-3-carboxamide
CID 136849809
3-cyano-N-[1-(4-methyl-6-oxo-1H-pyrimidin-2-yl)piperidin-4-yl]benzamide
CID 136662623
3-methoxy-1-methyl-N-[1-(4-methyl-6-oxo-1H-pyrimidin-2-yl)piperidin-4-yl]pyrazole-4-carboxamide
CID 136962376
N-cyclopentyl-2-(cyclopropylamino)-6-methylpyrimidine-4-carboxamide
CID 109319648
N-cyclopentyl-2,4-dimethylimidazo[1,5-a]pyrimidine-8-carboxamide
CID 145078540
N-cyclododecyl-2-(methylsulfanylmethyl)-6-oxo-1H-pyrimidine-4-carboxamide
CID 136705774
N-cyclohexyl-2-methyl-6-oxo-1H-pyridine-4-carboxamide
CID 110698595

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-1-(4-methyl-6-oxo-1H-pyrimidin-2-yl)pyrazole-3-carboxamide?
The IUPAC name of N-cyclopentyl-1-(4-methyl-6-oxo-1H-pyrimidin-2-yl)pyrazole-3-carboxamide (CID 137049042) is N-cyclopentyl-1-(4-methyl-6-oxo-1H-pyrimidin-2-yl)pyrazole-3-carboxamide.
What is the SMILES notation for N-cyclopentyl-1-(4-methyl-6-oxo-1H-pyrimidin-2-yl)pyrazole-3-carboxamide?
The canonical SMILES for N-cyclopentyl-1-(4-methyl-6-oxo-1H-pyrimidin-2-yl)pyrazole-3-carboxamide is Cc1cc(=O)[nH]c(-n2ccc(C(=O)NC3CCCC3)n2)n1.
What is the InChIKey of N-cyclopentyl-1-(4-methyl-6-oxo-1H-pyrimidin-2-yl)pyrazole-3-carboxamide?
The InChIKey is DOOQJXMELZCDKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N5O2/c1-9-8-12(20)17-14(15-9)19-7-6-11(18-19)13(21)16-10-4-2-3-5-10/h6-8,10H,2-5H2,1H3,(H,16,21)(H,15,17,20).
What are the key properties of N-cyclopentyl-1-(4-methyl-6-oxo-1H-pyrimidin-2-yl)pyrazole-3-carboxamide?
N-cyclopentyl-1-(4-methyl-6-oxo-1H-pyrimidin-2-yl)pyrazole-3-carboxamide has a molecular weight of 287.32 g/mol, XLogP of 0.94, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-1-(4-methyl-6-oxo-1H-pyrimidin-2-yl)pyrazole-3-carboxamide is sourced from PubChem (CID 137049042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).