2-cyclopropyl-6-oxo-1-(2-pyrrolidin-1-ylethyl)pyrimidine-4-carboxamide

C14H20N4O2 — CID 165411645

IUPAC2-cyclopropyl-6-oxo-1-(2-pyrrolidin-1-ylethyl)pyrimidine-4-carboxamide
SMILESNC(=O)c1cc(=O)n(CCN2CCCC2)c(C2CC2)n1
InChIInChI=1S/C14H20N4O2/c15-13(20)11-9-12(19)18(14(16-11)10-3-4-10)8-7-17-5-1-2-6-17/h9-10H,1-8H2,(H2,15,20)
InChIKeyRNPWVPCMZBRVPG-UHFFFAOYSA-N
MW276.34 g/mol
LogP0.32
Rot. Bonds5

About 2-cyclopropyl-6-oxo-1-(2-pyrrolidin-1-ylethyl)pyrimidine-4-carboxamide

2-cyclopropyl-6-oxo-1-(2-pyrrolidin-1-ylethyl)pyrimidine-4-carboxamide (PubChem CID 165411645) has the molecular formula C14H20N4O2 and a molecular weight of 276.34 g/mol. Its IUPAC name is 2-cyclopropyl-6-oxo-1-(2-pyrrolidin-1-ylethyl)pyrimidine-4-carboxamide.

Molecular Properties

Compound Name2-cyclopropyl-6-oxo-1-(2-pyrrolidin-1-ylethyl)pyrimidine-4-carboxamide
PubChem CID165411645
Molecular FormulaC14H20N4O2
Molecular Weight276.34 g/mol
Exact Mass276.16
IUPAC Name2-cyclopropyl-6-oxo-1-(2-pyrrolidin-1-ylethyl)pyrimidine-4-carboxamide
SMILESNC(=O)c1cc(=O)n(CCN2CCCC2)c(C2CC2)n1
InChIInChI=1S/C14H20N4O2/c15-13(20)11-9-12(19)18(14(16-11)10-3-4-10)8-7-17-5-1-2-6-17/h9-10H,1-8H2,(H2,15,20)
InChIKeyRNPWVPCMZBRVPG-UHFFFAOYSA-N
XLogP0.32
TPSA81.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 50.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-cyclopropyl-6-oxo-1-(2-pyrrolidin-1-ylethyl)pyrimidine-4-carboxamide 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 2-cyclopropyl-6-oxo-1-(2-pyrrolidin-1-ylethyl)pyrimidine-4-carboxamide?
The IUPAC name of 2-cyclopropyl-6-oxo-1-(2-pyrrolidin-1-ylethyl)pyrimidine-4-carboxamide (CID 165411645) is 2-cyclopropyl-6-oxo-1-(2-pyrrolidin-1-ylethyl)pyrimidine-4-carboxamide.
What is the SMILES notation for 2-cyclopropyl-6-oxo-1-(2-pyrrolidin-1-ylethyl)pyrimidine-4-carboxamide?
The canonical SMILES for 2-cyclopropyl-6-oxo-1-(2-pyrrolidin-1-ylethyl)pyrimidine-4-carboxamide is NC(=O)c1cc(=O)n(CCN2CCCC2)c(C2CC2)n1.
What is the InChIKey of 2-cyclopropyl-6-oxo-1-(2-pyrrolidin-1-ylethyl)pyrimidine-4-carboxamide?
The InChIKey is RNPWVPCMZBRVPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O2/c15-13(20)11-9-12(19)18(14(16-11)10-3-4-10)8-7-17-5-1-2-6-17/h9-10H,1-8H2,(H2,15,20).
What are the key properties of 2-cyclopropyl-6-oxo-1-(2-pyrrolidin-1-ylethyl)pyrimidine-4-carboxamide?
2-cyclopropyl-6-oxo-1-(2-pyrrolidin-1-ylethyl)pyrimidine-4-carboxamide has a molecular weight of 276.34 g/mol, XLogP of 0.32, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-6-oxo-1-(2-pyrrolidin-1-ylethyl)pyrimidine-4-carboxamide is sourced from PubChem (CID 165411645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).