8-chloro-3-cyclohexyl-1-methylimidazo[1,5-a]pyrazine

C13H16ClN3 — CID 143744436

IUPAC8-chloro-3-cyclohexyl-1-methylimidazo[1,5-a]pyrazine
SMILESCc1nc(C2CCCCC2)n2ccnc(Cl)c12
InChIInChI=1S/C13H16ClN3/c1-9-11-12(14)15-7-8-17(11)13(16-9)10-5-3-2-4-6-10/h7-8,10H,2-6H2,1H3
InChIKeyPWIWCPGKFQLLCI-UHFFFAOYSA-N
MW249.74 g/mol
LogP3.74
Rot. Bonds1

About 8-chloro-3-cyclohexyl-1-methylimidazo[1,5-a]pyrazine

8-chloro-3-cyclohexyl-1-methylimidazo[1,5-a]pyrazine (PubChem CID 143744436) has the molecular formula C13H16ClN3 and a molecular weight of 249.74 g/mol. Its IUPAC name is 8-chloro-3-cyclohexyl-1-methylimidazo[1,5-a]pyrazine.

Molecular Properties

Compound Name8-chloro-3-cyclohexyl-1-methylimidazo[1,5-a]pyrazine
PubChem CID143744436
Molecular FormulaC13H16ClN3
Molecular Weight249.74 g/mol
Exact Mass249.10
IUPAC Name8-chloro-3-cyclohexyl-1-methylimidazo[1,5-a]pyrazine
SMILESCc1nc(C2CCCCC2)n2ccnc(Cl)c12
InChIInChI=1S/C13H16ClN3/c1-9-11-12(14)15-7-8-17(11)13(16-9)10-5-3-2-4-6-10/h7-8,10H,2-6H2,1H3
InChIKeyPWIWCPGKFQLLCI-UHFFFAOYSA-N
XLogP3.74
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.74
LogP ≤ 53.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 8-chloro-3-cyclohexyl-1-methylimidazo[1,5-a]pyrazine?
The IUPAC name of 8-chloro-3-cyclohexyl-1-methylimidazo[1,5-a]pyrazine (CID 143744436) is 8-chloro-3-cyclohexyl-1-methylimidazo[1,5-a]pyrazine.
What is the SMILES notation for 8-chloro-3-cyclohexyl-1-methylimidazo[1,5-a]pyrazine?
The canonical SMILES for 8-chloro-3-cyclohexyl-1-methylimidazo[1,5-a]pyrazine is Cc1nc(C2CCCCC2)n2ccnc(Cl)c12.
What is the InChIKey of 8-chloro-3-cyclohexyl-1-methylimidazo[1,5-a]pyrazine?
The InChIKey is PWIWCPGKFQLLCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16ClN3/c1-9-11-12(14)15-7-8-17(11)13(16-9)10-5-3-2-4-6-10/h7-8,10H,2-6H2,1H3.
What are the key properties of 8-chloro-3-cyclohexyl-1-methylimidazo[1,5-a]pyrazine?
8-chloro-3-cyclohexyl-1-methylimidazo[1,5-a]pyrazine has a molecular weight of 249.74 g/mol, XLogP of 3.74, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-chloro-3-cyclohexyl-1-methylimidazo[1,5-a]pyrazine is sourced from PubChem (CID 143744436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).