N-[5-methyl-2-(4-methyl-6-oxo-1H-pyrimidin-2-yl)pyrazol-3-yl]cyclopentanecarboxamide

C15H19N5O2 — CID 135752898

IUPACN-[5-methyl-2-(4-methyl-6-oxo-1H-pyrimidin-2-yl)pyrazol-3-yl]cyclopentanecarboxamide
SMILESCc1cc(=O)[nH]c(-n2nc(C)cc2NC(=O)C2CCCC2)n1
InChIInChI=1S/C15H19N5O2/c1-9-8-13(21)18-15(16-9)20-12(7-10(2)19-20)17-14(22)11-5-3-4-6-11/h7-8,11H,3-6H2,1-2H3,(H,17,22)(H,16,18,21)
InChIKeyWECLZMSSJPHHPM-UHFFFAOYSA-N
MW301.35 g/mol
LogP1.70
Rot. Bonds3

About N-[5-methyl-2-(4-methyl-6-oxo-1H-pyrimidin-2-yl)pyrazol-3-yl]cyclopentanecarboxamide

N-[5-methyl-2-(4-methyl-6-oxo-1H-pyrimidin-2-yl)pyrazol-3-yl]cyclopentanecarboxamide (PubChem CID 135752898) has the molecular formula C15H19N5O2 and a molecular weight of 301.35 g/mol. Its IUPAC name is N-[5-methyl-2-(4-methyl-6-oxo-1H-pyrimidin-2-yl)pyrazol-3-yl]cyclopentanecarboxamide.

Molecular Properties

Compound NameN-[5-methyl-2-(4-methyl-6-oxo-1H-pyrimidin-2-yl)pyrazol-3-yl]cyclopentanecarboxamide
PubChem CID135752898
Molecular FormulaC15H19N5O2
Molecular Weight301.35 g/mol
Exact Mass301.15
IUPAC NameN-[5-methyl-2-(4-methyl-6-oxo-1H-pyrimidin-2-yl)pyrazol-3-yl]cyclopentanecarboxamide
SMILESCc1cc(=O)[nH]c(-n2nc(C)cc2NC(=O)C2CCCC2)n1
InChIInChI=1S/C15H19N5O2/c1-9-8-13(21)18-15(16-9)20-12(7-10(2)19-20)17-14(22)11-5-3-4-6-11/h7-8,11H,3-6H2,1-2H3,(H,17,22)(H,16,18,21)
InChIKeyWECLZMSSJPHHPM-UHFFFAOYSA-N
XLogP1.70
TPSA92.67 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.35
LogP ≤ 51.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[5-methyl-2-(4-methyl-6-oxo-1H-pyrimidin-2-yl)pyrazol-3-yl]cyclopentanecarboxamide?
The IUPAC name of N-[5-methyl-2-(4-methyl-6-oxo-1H-pyrimidin-2-yl)pyrazol-3-yl]cyclopentanecarboxamide (CID 135752898) is N-[5-methyl-2-(4-methyl-6-oxo-1H-pyrimidin-2-yl)pyrazol-3-yl]cyclopentanecarboxamide.
What is the SMILES notation for N-[5-methyl-2-(4-methyl-6-oxo-1H-pyrimidin-2-yl)pyrazol-3-yl]cyclopentanecarboxamide?
The canonical SMILES for N-[5-methyl-2-(4-methyl-6-oxo-1H-pyrimidin-2-yl)pyrazol-3-yl]cyclopentanecarboxamide is Cc1cc(=O)[nH]c(-n2nc(C)cc2NC(=O)C2CCCC2)n1.
What is the InChIKey of N-[5-methyl-2-(4-methyl-6-oxo-1H-pyrimidin-2-yl)pyrazol-3-yl]cyclopentanecarboxamide?
The InChIKey is WECLZMSSJPHHPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N5O2/c1-9-8-13(21)18-15(16-9)20-12(7-10(2)19-20)17-14(22)11-5-3-4-6-11/h7-8,11H,3-6H2,1-2H3,(H,17,22)(H,16,18,21).
What are the key properties of N-[5-methyl-2-(4-methyl-6-oxo-1H-pyrimidin-2-yl)pyrazol-3-yl]cyclopentanecarboxamide?
N-[5-methyl-2-(4-methyl-6-oxo-1H-pyrimidin-2-yl)pyrazol-3-yl]cyclopentanecarboxamide has a molecular weight of 301.35 g/mol, XLogP of 1.70, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-methyl-2-(4-methyl-6-oxo-1H-pyrimidin-2-yl)pyrazol-3-yl]cyclopentanecarboxamide is sourced from PubChem (CID 135752898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).