N-(3-hydroxy-2-methylbutan-2-yl)imidazo[1,2-a]pyrimidine-2-carboxamide

C12H16N4O2 — CID 75398211

IUPACN-(3-hydroxy-2-methylbutan-2-yl)imidazo[1,2-a]pyrimidine-2-carboxamide
SMILESCC(O)C(C)(C)NC(=O)c1cn2cccnc2n1
InChIInChI=1S/C12H16N4O2/c1-8(17)12(2,3)15-10(18)9-7-16-6-4-5-13-11(16)14-9/h4-8,17H,1-3H3,(H,15,18)
InChIKeyFZSDRIYLGDQSLW-UHFFFAOYSA-N
MW248.29 g/mol
LogP0.62
Rot. Bonds3

About N-(3-hydroxy-2-methylbutan-2-yl)imidazo[1,2-a]pyrimidine-2-carboxamide

N-(3-hydroxy-2-methylbutan-2-yl)imidazo[1,2-a]pyrimidine-2-carboxamide (PubChem CID 75398211) has the molecular formula C12H16N4O2 and a molecular weight of 248.29 g/mol. Its IUPAC name is N-(3-hydroxy-2-methylbutan-2-yl)imidazo[1,2-a]pyrimidine-2-carboxamide.

Molecular Properties

Compound NameN-(3-hydroxy-2-methylbutan-2-yl)imidazo[1,2-a]pyrimidine-2-carboxamide
PubChem CID75398211
Molecular FormulaC12H16N4O2
Molecular Weight248.29 g/mol
Exact Mass248.13
IUPAC NameN-(3-hydroxy-2-methylbutan-2-yl)imidazo[1,2-a]pyrimidine-2-carboxamide
SMILESCC(O)C(C)(C)NC(=O)c1cn2cccnc2n1
InChIInChI=1S/C12H16N4O2/c1-8(17)12(2,3)15-10(18)9-7-16-6-4-5-13-11(16)14-9/h4-8,17H,1-3H3,(H,15,18)
InChIKeyFZSDRIYLGDQSLW-UHFFFAOYSA-N
XLogP0.62
TPSA79.52 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.29
LogP ≤ 50.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-(3-hydroxy-2-methylbutan-2-yl)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-(3-hydroxy-2-methylbutan-2-yl)imidazo[1,2-a]pyrimidine-2-carboxamide?
The IUPAC name of N-(3-hydroxy-2-methylbutan-2-yl)imidazo[1,2-a]pyrimidine-2-carboxamide (CID 75398211) is N-(3-hydroxy-2-methylbutan-2-yl)imidazo[1,2-a]pyrimidine-2-carboxamide.
What is the SMILES notation for N-(3-hydroxy-2-methylbutan-2-yl)imidazo[1,2-a]pyrimidine-2-carboxamide?
The canonical SMILES for N-(3-hydroxy-2-methylbutan-2-yl)imidazo[1,2-a]pyrimidine-2-carboxamide is CC(O)C(C)(C)NC(=O)c1cn2cccnc2n1.
What is the InChIKey of N-(3-hydroxy-2-methylbutan-2-yl)imidazo[1,2-a]pyrimidine-2-carboxamide?
The InChIKey is FZSDRIYLGDQSLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N4O2/c1-8(17)12(2,3)15-10(18)9-7-16-6-4-5-13-11(16)14-9/h4-8,17H,1-3H3,(H,15,18).
What are the key properties of N-(3-hydroxy-2-methylbutan-2-yl)imidazo[1,2-a]pyrimidine-2-carboxamide?
N-(3-hydroxy-2-methylbutan-2-yl)imidazo[1,2-a]pyrimidine-2-carboxamide has a molecular weight of 248.29 g/mol, XLogP of 0.62, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-hydroxy-2-methylbutan-2-yl)imidazo[1,2-a]pyrimidine-2-carboxamide is sourced from PubChem (CID 75398211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).