2-chloro-4-methyl-6-propan-2-ylimidazo[1,5-a]pyrimidine

C10H12ClN3 — CID 13015250

IUPAC2-chloro-4-methyl-6-propan-2-ylimidazo[1,5-a]pyrimidine
SMILESCc1cc(Cl)nc2cnc(C(C)C)n12
InChIInChI=1S/C10H12ClN3/c1-6(2)10-12-5-9-13-8(11)4-7(3)14(9)10/h4-6H,1-3H3
InChIKeyAPQIPGPKTZWPEZ-UHFFFAOYSA-N
MW209.68 g/mol
LogP2.81
Rot. Bonds1

About 2-chloro-4-methyl-6-propan-2-ylimidazo[1,5-a]pyrimidine

2-chloro-4-methyl-6-propan-2-ylimidazo[1,5-a]pyrimidine (PubChem CID 13015250) has the molecular formula C10H12ClN3 and a molecular weight of 209.68 g/mol. Its IUPAC name is 2-chloro-4-methyl-6-propan-2-ylimidazo[1,5-a]pyrimidine.

Molecular Properties

Compound Name2-chloro-4-methyl-6-propan-2-ylimidazo[1,5-a]pyrimidine
PubChem CID13015250
Molecular FormulaC10H12ClN3
Molecular Weight209.68 g/mol
Exact Mass209.07
IUPAC Name2-chloro-4-methyl-6-propan-2-ylimidazo[1,5-a]pyrimidine
SMILESCc1cc(Cl)nc2cnc(C(C)C)n12
InChIInChI=1S/C10H12ClN3/c1-6(2)10-12-5-9-13-8(11)4-7(3)14(9)10/h4-6H,1-3H3
InChIKeyAPQIPGPKTZWPEZ-UHFFFAOYSA-N
XLogP2.81
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.68
LogP ≤ 52.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-chloro-4-methyl-6-propan-2-ylimidazo[1,5-a]pyrimidine 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-chloro-4-methyl-6-propan-2-ylimidazo[1,5-a]pyrimidine?
The IUPAC name of 2-chloro-4-methyl-6-propan-2-ylimidazo[1,5-a]pyrimidine (CID 13015250) is 2-chloro-4-methyl-6-propan-2-ylimidazo[1,5-a]pyrimidine.
What is the SMILES notation for 2-chloro-4-methyl-6-propan-2-ylimidazo[1,5-a]pyrimidine?
The canonical SMILES for 2-chloro-4-methyl-6-propan-2-ylimidazo[1,5-a]pyrimidine is Cc1cc(Cl)nc2cnc(C(C)C)n12.
What is the InChIKey of 2-chloro-4-methyl-6-propan-2-ylimidazo[1,5-a]pyrimidine?
The InChIKey is APQIPGPKTZWPEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12ClN3/c1-6(2)10-12-5-9-13-8(11)4-7(3)14(9)10/h4-6H,1-3H3.
What are the key properties of 2-chloro-4-methyl-6-propan-2-ylimidazo[1,5-a]pyrimidine?
2-chloro-4-methyl-6-propan-2-ylimidazo[1,5-a]pyrimidine has a molecular weight of 209.68 g/mol, XLogP of 2.81, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-4-methyl-6-propan-2-ylimidazo[1,5-a]pyrimidine is sourced from PubChem (CID 13015250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).