5-methyl-N-[(4-piperidin-1-ylsulfonylphenyl)methyl]imidazo[1,2-a]pyridine-2-carboxamide

C21H24N4O3S — CID 55382516

IUPAC5-methyl-N-[(4-piperidin-1-ylsulfonylphenyl)methyl]imidazo[1,2-a]pyridine-2-carboxamide
SMILESCc1cccc2nc(C(=O)NCc3ccc(S(=O)(=O)N4CCCCC4)cc3)cn12
InChIInChI=1S/C21H24N4O3S/c1-16-6-5-7-20-23-19(15-25(16)20)21(26)22-14-17-8-10-18(11-9-17)29(27,28)24-12-3-2-4-13-24/h5-11,15H,2-4,12-14H2,1H3,(H,22,26)
InChIKeySZLGGUJFVNUYKX-UHFFFAOYSA-N
MW412.52 g/mol
LogP2.75
Rot. Bonds5

About 5-methyl-N-[(4-piperidin-1-ylsulfonylphenyl)methyl]imidazo[1,2-a]pyridine-2-carboxamide

5-methyl-N-[(4-piperidin-1-ylsulfonylphenyl)methyl]imidazo[1,2-a]pyridine-2-carboxamide (PubChem CID 55382516) has the molecular formula C21H24N4O3S and a molecular weight of 412.52 g/mol. Its IUPAC name is 5-methyl-N-[(4-piperidin-1-ylsulfonylphenyl)methyl]imidazo[1,2-a]pyridine-2-carboxamide.

Molecular Properties

Compound Name5-methyl-N-[(4-piperidin-1-ylsulfonylphenyl)methyl]imidazo[1,2-a]pyridine-2-carboxamide
PubChem CID55382516
Molecular FormulaC21H24N4O3S
Molecular Weight412.52 g/mol
Exact Mass412.16
IUPAC Name5-methyl-N-[(4-piperidin-1-ylsulfonylphenyl)methyl]imidazo[1,2-a]pyridine-2-carboxamide
SMILESCc1cccc2nc(C(=O)NCc3ccc(S(=O)(=O)N4CCCCC4)cc3)cn12
InChIInChI=1S/C21H24N4O3S/c1-16-6-5-7-20-23-19(15-25(16)20)21(26)22-14-17-8-10-18(11-9-17)29(27,28)24-12-3-2-4-13-24/h5-11,15H,2-4,12-14H2,1H3,(H,22,26)
InChIKeySZLGGUJFVNUYKX-UHFFFAOYSA-N
XLogP2.75
TPSA83.78 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500412.52
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-methyl-N-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]imidazo[1,2-a]pyridine-2-carboxamide
CID 55395152
5-methyl-1-phenyl-N-[(4-piperidin-1-ylsulfonylphenyl)methyl]pyrazole-3-carboxamide
CID 55756785
4-methyl-N-[(4-pyrrolidin-1-ylsulfonylphenyl)methyl]quinoline-2-carboxamide
CID 46974547
5-methyl-N-[4-(3-methylpiperidin-1-yl)sulfonylphenyl]imidazo[1,2-a]pyridine-2-carboxamide
CID 55332921
N-[(4-methylphenyl)methyl]-4-piperidin-1-ylsulfonylbenzamide
CID 2694596
N-[(4-pyrrolidin-1-ylsulfonylphenyl)methyl]quinoxaline-2-carboxamide
CID 55737335
N-[(4-piperidin-1-ylsulfonylphenyl)methyl]pyrazine-2-carboxamide
CID 51197502
[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-(5-methylimidazo[1,2-a]pyridin-2-yl)methanone
CID 26202304
N-[(4-piperidin-1-ylsulfonylphenyl)methyl]-1H-indole-3-carboxamide
CID 17457202
N-[4-[(2S,6S)-2,6-dimethylmorpholin-4-yl]sulfonylphenyl]-5-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 41170489
4-(5-methylpyrazol-1-yl)-N-[(4-piperidin-1-ylsulfonylphenyl)methyl]benzamide
CID 18209836
1-methyl-4-pyrrolidin-1-ylsulfonyl-N-[(4-pyrrolidin-1-ylsulfonylphenyl)methyl]pyrrole-2-carboxamide
CID 55737275

Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-[(4-piperidin-1-ylsulfonylphenyl)methyl]imidazo[1,2-a]pyridine-2-carboxamide?
The IUPAC name of 5-methyl-N-[(4-piperidin-1-ylsulfonylphenyl)methyl]imidazo[1,2-a]pyridine-2-carboxamide (CID 55382516) is 5-methyl-N-[(4-piperidin-1-ylsulfonylphenyl)methyl]imidazo[1,2-a]pyridine-2-carboxamide.
What is the SMILES notation for 5-methyl-N-[(4-piperidin-1-ylsulfonylphenyl)methyl]imidazo[1,2-a]pyridine-2-carboxamide?
The canonical SMILES for 5-methyl-N-[(4-piperidin-1-ylsulfonylphenyl)methyl]imidazo[1,2-a]pyridine-2-carboxamide is Cc1cccc2nc(C(=O)NCc3ccc(S(=O)(=O)N4CCCCC4)cc3)cn12.
What is the InChIKey of 5-methyl-N-[(4-piperidin-1-ylsulfonylphenyl)methyl]imidazo[1,2-a]pyridine-2-carboxamide?
The InChIKey is SZLGGUJFVNUYKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N4O3S/c1-16-6-5-7-20-23-19(15-25(16)20)21(26)22-14-17-8-10-18(11-9-17)29(27,28)24-12-3-2-4-13-24/h5-11,15H,2-4,12-14H2,1H3,(H,22,26).
What are the key properties of 5-methyl-N-[(4-piperidin-1-ylsulfonylphenyl)methyl]imidazo[1,2-a]pyridine-2-carboxamide?
5-methyl-N-[(4-piperidin-1-ylsulfonylphenyl)methyl]imidazo[1,2-a]pyridine-2-carboxamide has a molecular weight of 412.52 g/mol, XLogP of 2.75, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-[(4-piperidin-1-ylsulfonylphenyl)methyl]imidazo[1,2-a]pyridine-2-carboxamide is sourced from PubChem (CID 55382516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).