N-(2-aminoethyl)-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide;hydrochloride

C11H15ClN4O3S — CID 119384120

IUPACN-(2-aminoethyl)-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide;hydrochloride
SMILESCS(=O)(=O)c1nc(C(=O)NCCN)c2ccccn12.Cl
InChIInChI=1S/C11H14N4O3S.ClH/c1-19(17,18)11-14-9(10(16)13-6-5-12)8-4-2-3-7-15(8)11;/h2-4,7H,5-6,12H2,1H3,(H,13,16);1H
InChIKeyAJBSXQRAUVBTGM-UHFFFAOYSA-N
MW318.79 g/mol
LogP-0.15
Rot. Bonds4

About N-(2-aminoethyl)-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide;hydrochloride

N-(2-aminoethyl)-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide;hydrochloride (PubChem CID 119384120) has the molecular formula C11H15ClN4O3S and a molecular weight of 318.79 g/mol. Its IUPAC name is N-(2-aminoethyl)-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(2-aminoethyl)-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide;hydrochloride
PubChem CID119384120
Molecular FormulaC11H15ClN4O3S
Molecular Weight318.79 g/mol
Exact Mass318.06
IUPAC NameN-(2-aminoethyl)-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide;hydrochloride
SMILESCS(=O)(=O)c1nc(C(=O)NCCN)c2ccccn12.Cl
InChIInChI=1S/C11H14N4O3S.ClH/c1-19(17,18)11-14-9(10(16)13-6-5-12)8-4-2-3-7-15(8)11;/h2-4,7H,5-6,12H2,1H3,(H,13,16);1H
InChIKeyAJBSXQRAUVBTGM-UHFFFAOYSA-N
XLogP-0.15
TPSA106.56 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.79
LogP ≤ 5-0.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-(3-aminopropyl)-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide;hydrochloride
CID 119407322
N-[3-(methylamino)propyl]-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide;hydrochloride
CID 119432312
N-(3-amino-2-methylpropyl)-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide
CID 119995798
3-methylsulfonyl-N-prop-2-ynylimidazo[1,5-a]pyridine-1-carboxamide
CID 47401298
N-(1-amino-4-methylpentan-2-yl)-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide;hydrochloride
CID 119587427
N-[2-(methylamino)propyl]-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide
CID 120832749
N-(4-aminocyclohexyl)-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide;hydrochloride
CID 119477193
N-(1-aminohexan-2-yl)-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide;hydrochloride
CID 119667168
N-(3-aminopropyl)-N-benzyl-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide;hydrochloride
CID 120649325
N-[2-(benzylamino)-2-oxoethyl]-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide
CID 47783322
3-methylsulfonyl-N-[(4-methyl-1,2,4-triazol-3-yl)methyl]imidazo[1,5-a]pyridine-1-carboxamide
CID 51094608
N-[(5-methyl-1,2-oxazol-3-yl)methyl]-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide
CID 51094701

Frequently Asked Questions

What is the IUPAC name of N-(2-aminoethyl)-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide;hydrochloride?
The IUPAC name of N-(2-aminoethyl)-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide;hydrochloride (CID 119384120) is N-(2-aminoethyl)-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide;hydrochloride.
What is the SMILES notation for N-(2-aminoethyl)-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide;hydrochloride?
The canonical SMILES for N-(2-aminoethyl)-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide;hydrochloride is CS(=O)(=O)c1nc(C(=O)NCCN)c2ccccn12.Cl.
What is the InChIKey of N-(2-aminoethyl)-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide;hydrochloride?
The InChIKey is AJBSXQRAUVBTGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4O3S.ClH/c1-19(17,18)11-14-9(10(16)13-6-5-12)8-4-2-3-7-15(8)11;/h2-4,7H,5-6,12H2,1H3,(H,13,16);1H.
What are the key properties of N-(2-aminoethyl)-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide;hydrochloride?
N-(2-aminoethyl)-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide;hydrochloride has a molecular weight of 318.79 g/mol, XLogP of -0.15, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminoethyl)-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide;hydrochloride is sourced from PubChem (CID 119384120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).