N-ethyl-N-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyrimidine-2-carboxamide

C11H11F3N4O — CID 74236506

IUPACN-ethyl-N-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyrimidine-2-carboxamide
SMILESCCN(CC(F)(F)F)C(=O)c1cn2cccnc2n1
InChIInChI=1S/C11H11F3N4O/c1-2-17(7-11(12,13)14)9(19)8-6-18-5-3-4-15-10(18)16-8/h3-6H,2,7H2,1H3
InChIKeyYDJBMKRLMACQNZ-UHFFFAOYSA-N
MW272.23 g/mol
LogP1.75
Rot. Bonds3

About N-ethyl-N-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyrimidine-2-carboxamide

N-ethyl-N-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyrimidine-2-carboxamide (PubChem CID 74236506) has the molecular formula C11H11F3N4O and a molecular weight of 272.23 g/mol. Its IUPAC name is N-ethyl-N-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyrimidine-2-carboxamide.

Molecular Properties

Compound NameN-ethyl-N-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyrimidine-2-carboxamide
PubChem CID74236506
Molecular FormulaC11H11F3N4O
Molecular Weight272.23 g/mol
Exact Mass272.09
IUPAC NameN-ethyl-N-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyrimidine-2-carboxamide
SMILESCCN(CC(F)(F)F)C(=O)c1cn2cccnc2n1
InChIInChI=1S/C11H11F3N4O/c1-2-17(7-11(12,13)14)9(19)8-6-18-5-3-4-15-10(18)16-8/h3-6H,2,7H2,1H3
InChIKeyYDJBMKRLMACQNZ-UHFFFAOYSA-N
XLogP1.75
TPSA50.50 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.23
LogP ≤ 51.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze N-ethyl-N-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyrimidine-2-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 N-ethyl-N-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyrimidine-2-carboxamide?
The IUPAC name of N-ethyl-N-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyrimidine-2-carboxamide (CID 74236506) is N-ethyl-N-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyrimidine-2-carboxamide.
What is the SMILES notation for N-ethyl-N-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyrimidine-2-carboxamide?
The canonical SMILES for N-ethyl-N-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyrimidine-2-carboxamide is CCN(CC(F)(F)F)C(=O)c1cn2cccnc2n1.
What is the InChIKey of N-ethyl-N-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyrimidine-2-carboxamide?
The InChIKey is YDJBMKRLMACQNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11F3N4O/c1-2-17(7-11(12,13)14)9(19)8-6-18-5-3-4-15-10(18)16-8/h3-6H,2,7H2,1H3.
What are the key properties of N-ethyl-N-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyrimidine-2-carboxamide?
N-ethyl-N-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyrimidine-2-carboxamide has a molecular weight of 272.23 g/mol, XLogP of 1.75, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyrimidine-2-carboxamide is sourced from PubChem (CID 74236506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).