2-chloro-4,6,8-trimethylimidazo[1,5-a]pyrimidine

C9H10ClN3 — CID 13114256

IUPAC2-chloro-4,6,8-trimethylimidazo[1,5-a]pyrimidine
SMILESCc1nc(C)n2c(C)cc(Cl)nc12
InChIInChI=1S/C9H10ClN3/c1-5-4-8(10)12-9-6(2)11-7(3)13(5)9/h4H,1-3H3
InChIKeyYPCURNIRMGYHFU-UHFFFAOYSA-N
MW195.65 g/mol
LogP2.31
Rot. Bonds

About 2-chloro-4,6,8-trimethylimidazo[1,5-a]pyrimidine

2-chloro-4,6,8-trimethylimidazo[1,5-a]pyrimidine (PubChem CID 13114256) has the molecular formula C9H10ClN3 and a molecular weight of 195.65 g/mol. Its IUPAC name is 2-chloro-4,6,8-trimethylimidazo[1,5-a]pyrimidine.

Molecular Properties

Compound Name2-chloro-4,6,8-trimethylimidazo[1,5-a]pyrimidine
PubChem CID13114256
Molecular FormulaC9H10ClN3
Molecular Weight195.65 g/mol
Exact Mass195.06
IUPAC Name2-chloro-4,6,8-trimethylimidazo[1,5-a]pyrimidine
SMILESCc1nc(C)n2c(C)cc(Cl)nc12
InChIInChI=1S/C9H10ClN3/c1-5-4-8(10)12-9-6(2)11-7(3)13(5)9/h4H,1-3H3
InChIKeyYPCURNIRMGYHFU-UHFFFAOYSA-N
XLogP2.31
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.65
LogP ≤ 52.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-chloro-4,6,8-trimethylimidazo[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-4,6,8-trimethylimidazo[1,5-a]pyrimidine?
The IUPAC name of 2-chloro-4,6,8-trimethylimidazo[1,5-a]pyrimidine (CID 13114256) is 2-chloro-4,6,8-trimethylimidazo[1,5-a]pyrimidine.
What is the SMILES notation for 2-chloro-4,6,8-trimethylimidazo[1,5-a]pyrimidine?
The canonical SMILES for 2-chloro-4,6,8-trimethylimidazo[1,5-a]pyrimidine is Cc1nc(C)n2c(C)cc(Cl)nc12.
What is the InChIKey of 2-chloro-4,6,8-trimethylimidazo[1,5-a]pyrimidine?
The InChIKey is YPCURNIRMGYHFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10ClN3/c1-5-4-8(10)12-9-6(2)11-7(3)13(5)9/h4H,1-3H3.
What are the key properties of 2-chloro-4,6,8-trimethylimidazo[1,5-a]pyrimidine?
2-chloro-4,6,8-trimethylimidazo[1,5-a]pyrimidine has a molecular weight of 195.65 g/mol, XLogP of 2.31, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-4,6,8-trimethylimidazo[1,5-a]pyrimidine is sourced from PubChem (CID 13114256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).