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

C16H21N5O2 — CID 135753037

IUPACN-[2-(4-ethyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]cyclopentanecarboxamide
SMILESCCc1cc(=O)[nH]c(-n2nc(C)cc2NC(=O)C2CCCC2)n1
InChIInChI=1S/C16H21N5O2/c1-3-12-9-14(22)19-16(17-12)21-13(8-10(2)20-21)18-15(23)11-6-4-5-7-11/h8-9,11H,3-7H2,1-2H3,(H,18,23)(H,17,19,22)
InChIKeyZFSOOMSCBRDXFC-UHFFFAOYSA-N
MW315.38 g/mol
LogP1.96
Rot. Bonds4

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

N-[2-(4-ethyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]cyclopentanecarboxamide (PubChem CID 135753037) has the molecular formula C16H21N5O2 and a molecular weight of 315.38 g/mol. Its IUPAC name is N-[2-(4-ethyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]cyclopentanecarboxamide.

Molecular Properties

Compound NameN-[2-(4-ethyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]cyclopentanecarboxamide
PubChem CID135753037
Molecular FormulaC16H21N5O2
Molecular Weight315.38 g/mol
Exact Mass315.17
IUPAC NameN-[2-(4-ethyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]cyclopentanecarboxamide
SMILESCCc1cc(=O)[nH]c(-n2nc(C)cc2NC(=O)C2CCCC2)n1
InChIInChI=1S/C16H21N5O2/c1-3-12-9-14(22)19-16(17-12)21-13(8-10(2)20-21)18-15(23)11-6-4-5-7-11/h8-9,11H,3-7H2,1-2H3,(H,18,23)(H,17,19,22)
InChIKeyZFSOOMSCBRDXFC-UHFFFAOYSA-N
XLogP1.96
TPSA92.67 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.38
LogP ≤ 51.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-[2-(4-ethyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]cyclopentanecarboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-ethyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]cyclopentanecarboxamide?
The IUPAC name of N-[2-(4-ethyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]cyclopentanecarboxamide (CID 135753037) is N-[2-(4-ethyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]cyclopentanecarboxamide.
What is the SMILES notation for N-[2-(4-ethyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]cyclopentanecarboxamide?
The canonical SMILES for N-[2-(4-ethyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]cyclopentanecarboxamide is CCc1cc(=O)[nH]c(-n2nc(C)cc2NC(=O)C2CCCC2)n1.
What is the InChIKey of N-[2-(4-ethyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]cyclopentanecarboxamide?
The InChIKey is ZFSOOMSCBRDXFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N5O2/c1-3-12-9-14(22)19-16(17-12)21-13(8-10(2)20-21)18-15(23)11-6-4-5-7-11/h8-9,11H,3-7H2,1-2H3,(H,18,23)(H,17,19,22).
What are the key properties of N-[2-(4-ethyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]cyclopentanecarboxamide?
N-[2-(4-ethyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]cyclopentanecarboxamide has a molecular weight of 315.38 g/mol, XLogP of 1.96, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-ethyl-6-oxo-1H-pyrimidin-2-yl)-5-methylpyrazol-3-yl]cyclopentanecarboxamide is sourced from PubChem (CID 135753037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).