N-(4-aminocyclohexyl)-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide;hydrochloride

C15H21ClN4O3S — CID 119477193

IUPACN-(4-aminocyclohexyl)-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide;hydrochloride
SMILESCS(=O)(=O)c1nc(C(=O)NC2CCC(N)CC2)c2ccccn12.Cl
InChIInChI=1S/C15H20N4O3S.ClH/c1-23(21,22)15-18-13(12-4-2-3-9-19(12)15)14(20)17-11-7-5-10(16)6-8-11;/h2-4,9-11H,5-8,16H2,1H3,(H,17,20);1H
InChIKeyJPPLQHHXPSUCTC-UHFFFAOYSA-N
MW372.88 g/mol
LogP1.16
Rot. Bonds3

About N-(4-aminocyclohexyl)-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide;hydrochloride

N-(4-aminocyclohexyl)-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide;hydrochloride (PubChem CID 119477193) has the molecular formula C15H21ClN4O3S and a molecular weight of 372.88 g/mol. Its IUPAC name is N-(4-aminocyclohexyl)-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(4-aminocyclohexyl)-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide;hydrochloride
PubChem CID119477193
Molecular FormulaC15H21ClN4O3S
Molecular Weight372.88 g/mol
Exact Mass372.10
IUPAC NameN-(4-aminocyclohexyl)-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide;hydrochloride
SMILESCS(=O)(=O)c1nc(C(=O)NC2CCC(N)CC2)c2ccccn12.Cl
InChIInChI=1S/C15H20N4O3S.ClH/c1-23(21,22)15-18-13(12-4-2-3-9-19(12)15)14(20)17-11-7-5-10(16)6-8-11;/h2-4,9-11H,5-8,16H2,1H3,(H,17,20);1H
InChIKeyJPPLQHHXPSUCTC-UHFFFAOYSA-N
XLogP1.16
TPSA106.56 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.88
LogP ≤ 51.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(4-aminocyclohexyl)-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide;hydrochloride?
The IUPAC name of N-(4-aminocyclohexyl)-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide;hydrochloride (CID 119477193) is N-(4-aminocyclohexyl)-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide;hydrochloride.
What is the SMILES notation for N-(4-aminocyclohexyl)-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide;hydrochloride?
The canonical SMILES for N-(4-aminocyclohexyl)-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide;hydrochloride is CS(=O)(=O)c1nc(C(=O)NC2CCC(N)CC2)c2ccccn12.Cl.
What is the InChIKey of N-(4-aminocyclohexyl)-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide;hydrochloride?
The InChIKey is JPPLQHHXPSUCTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O3S.ClH/c1-23(21,22)15-18-13(12-4-2-3-9-19(12)15)14(20)17-11-7-5-10(16)6-8-11;/h2-4,9-11H,5-8,16H2,1H3,(H,17,20);1H.
What are the key properties of N-(4-aminocyclohexyl)-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide;hydrochloride?
N-(4-aminocyclohexyl)-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide;hydrochloride has a molecular weight of 372.88 g/mol, XLogP of 1.16, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-aminocyclohexyl)-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide;hydrochloride is sourced from PubChem (CID 119477193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).