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

C19H23ClN4O3S — CID 120649325

IUPACN-(3-aminopropyl)-N-benzyl-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide;hydrochloride
SMILESCS(=O)(=O)c1nc(C(=O)N(CCCN)Cc2ccccc2)c2ccccn12.Cl
InChIInChI=1S/C19H22N4O3S.ClH/c1-27(25,26)19-21-17(16-10-5-6-13-23(16)19)18(24)22(12-7-11-20)14-15-8-3-2-4-9-15;/h2-6,8-10,13H,7,11-12,14,20H2,1H3;1H
InChIKeyLMORYCBALVPZFI-UHFFFAOYSA-N
MW422.94 g/mol
LogP2.15
Rot. Bonds7

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

N-(3-aminopropyl)-N-benzyl-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide;hydrochloride (PubChem CID 120649325) has the molecular formula C19H23ClN4O3S and a molecular weight of 422.94 g/mol. Its IUPAC name is N-(3-aminopropyl)-N-benzyl-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(3-aminopropyl)-N-benzyl-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide;hydrochloride
PubChem CID120649325
Molecular FormulaC19H23ClN4O3S
Molecular Weight422.94 g/mol
Exact Mass422.12
IUPAC NameN-(3-aminopropyl)-N-benzyl-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide;hydrochloride
SMILESCS(=O)(=O)c1nc(C(=O)N(CCCN)Cc2ccccc2)c2ccccn12.Cl
InChIInChI=1S/C19H22N4O3S.ClH/c1-27(25,26)19-21-17(16-10-5-6-13-23(16)19)18(24)22(12-7-11-20)14-15-8-3-2-4-9-15;/h2-6,8-10,13H,7,11-12,14,20H2,1H3;1H
InChIKeyLMORYCBALVPZFI-UHFFFAOYSA-N
XLogP2.15
TPSA97.77 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500422.94
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-(3-aminopropyl)-N-benzyl-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(3-aminopropyl)-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide;hydrochloride
CID 119407322
N-(2-aminoethyl)-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide;hydrochloride
CID 119384120
N-(1,3-benzodioxol-5-ylmethyl)-N-ethyl-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide
CID 47781283
N-[2-(benzylamino)-2-oxoethyl]-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide
CID 47783322
N-(3-aminopropyl)-N-benzyl-1-methylpyrazole-3-carboxamide
CID 107365593
3-methylsulfonyl-N-prop-2-ynylimidazo[1,5-a]pyridine-1-carboxamide
CID 47401298
2,2,2-trifluoro-1-(3-methylsulfonylimidazo[1,5-a]pyridin-1-yl)ethanone
CID 12617475
N-(3-aminopropyl)-N-benzyl-2-methylsulfonylacetamide
CID 107366137
N-(3-aminopropyl)-N-benzyl-3-hydroxypyridine-2-carboxamide
CID 107366166
N-(3-aminopropyl)-N-benzyl-2-methylsulfonylpropanamide;hydrochloride
CID 120648412
N-[(2R)-1-hydroxypropan-2-yl]-N-[(2R)-2-hydroxypropyl]-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide
CID 100663189
N-(1-aminohexan-2-yl)-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide;hydrochloride
CID 119667168

Frequently Asked Questions

What is the IUPAC name of N-(3-aminopropyl)-N-benzyl-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide;hydrochloride?
The IUPAC name of N-(3-aminopropyl)-N-benzyl-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide;hydrochloride (CID 120649325) is N-(3-aminopropyl)-N-benzyl-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide;hydrochloride.
What is the SMILES notation for N-(3-aminopropyl)-N-benzyl-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide;hydrochloride?
The canonical SMILES for N-(3-aminopropyl)-N-benzyl-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide;hydrochloride is CS(=O)(=O)c1nc(C(=O)N(CCCN)Cc2ccccc2)c2ccccn12.Cl.
What is the InChIKey of N-(3-aminopropyl)-N-benzyl-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide;hydrochloride?
The InChIKey is LMORYCBALVPZFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N4O3S.ClH/c1-27(25,26)19-21-17(16-10-5-6-13-23(16)19)18(24)22(12-7-11-20)14-15-8-3-2-4-9-15;/h2-6,8-10,13H,7,11-12,14,20H2,1H3;1H.
What are the key properties of N-(3-aminopropyl)-N-benzyl-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide;hydrochloride?
N-(3-aminopropyl)-N-benzyl-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide;hydrochloride has a molecular weight of 422.94 g/mol, XLogP of 2.15, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-aminopropyl)-N-benzyl-3-methylsulfonylimidazo[1,5-a]pyridine-1-carboxamide;hydrochloride is sourced from PubChem (CID 120649325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).