N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-4-pyrrolidin-1-ylsulfonylbutanamide

C22H26N4O3S — CID 112844900

IUPACN-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-4-pyrrolidin-1-ylsulfonylbutanamide
SMILESCc1cccn2c(NC(=O)CCCS(=O)(=O)N3CCCC3)c(-c3ccccc3)nc12
InChIInChI=1S/C22H26N4O3S/c1-17-9-7-15-26-21(17)24-20(18-10-3-2-4-11-18)22(26)23-19(27)12-8-16-30(28,29)25-13-5-6-14-25/h2-4,7,9-11,15H,5-6,8,12-14,16H2,1H3,(H,23,27)
InChIKeyLNUGCCILSSHBCM-UHFFFAOYSA-N
MW426.54 g/mol
LogP3.45
Rot. Bonds7

About N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-4-pyrrolidin-1-ylsulfonylbutanamide

N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-4-pyrrolidin-1-ylsulfonylbutanamide (PubChem CID 112844900) has the molecular formula C22H26N4O3S and a molecular weight of 426.54 g/mol. Its IUPAC name is N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-4-pyrrolidin-1-ylsulfonylbutanamide.

Molecular Properties

Compound NameN-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-4-pyrrolidin-1-ylsulfonylbutanamide
PubChem CID112844900
Molecular FormulaC22H26N4O3S
Molecular Weight426.54 g/mol
Exact Mass426.17
IUPAC NameN-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-4-pyrrolidin-1-ylsulfonylbutanamide
SMILESCc1cccn2c(NC(=O)CCCS(=O)(=O)N3CCCC3)c(-c3ccccc3)nc12
InChIInChI=1S/C22H26N4O3S/c1-17-9-7-15-26-21(17)24-20(18-10-3-2-4-11-18)22(26)23-19(27)12-8-16-30(28,29)25-13-5-6-14-25/h2-4,7,9-11,15H,5-6,8,12-14,16H2,1H3,(H,23,27)
InChIKeyLNUGCCILSSHBCM-UHFFFAOYSA-N
XLogP3.45
TPSA83.78 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500426.54
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-4-pyrrolidin-1-ylsulfonylbutanamide 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-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-3-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide
CID 32622076
3-cyclopentyl-N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)propanamide
CID 16559332
N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-3-[(2R)-oxolan-2-yl]propanamide
CID 94092022
N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-4-oxo-4-(5-phenyl-3,4-dihydropyrazol-2-yl)butanamide
CID 55540978
N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)cyclohexanecarboxamide
CID 18282898
3-(2,5-dimethoxyphenyl)-N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)propanamide
CID 46539218
N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-2-(2,2,2-trifluoroethoxy)acetamide
CID 55756203
2-[(3aR,7aR)-1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl]-N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)acetamide
CID 92738385
N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-3-(3-oxo-1,4-benzoxazin-4-yl)propanamide
CID 25341536
2-(2-fluorophenoxy)-N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)acetamide
CID 40656268
N-(2-iodophenyl)-4-pyrrolidin-1-ylsulfonylbutanamide
CID 112844619
(3R)-N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)oxolane-3-carboxamide
CID 95272020

Frequently Asked Questions

What is the IUPAC name of N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-4-pyrrolidin-1-ylsulfonylbutanamide?
The IUPAC name of N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-4-pyrrolidin-1-ylsulfonylbutanamide (CID 112844900) is N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-4-pyrrolidin-1-ylsulfonylbutanamide.
What is the SMILES notation for N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-4-pyrrolidin-1-ylsulfonylbutanamide?
The canonical SMILES for N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-4-pyrrolidin-1-ylsulfonylbutanamide is Cc1cccn2c(NC(=O)CCCS(=O)(=O)N3CCCC3)c(-c3ccccc3)nc12.
What is the InChIKey of N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-4-pyrrolidin-1-ylsulfonylbutanamide?
The InChIKey is LNUGCCILSSHBCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N4O3S/c1-17-9-7-15-26-21(17)24-20(18-10-3-2-4-11-18)22(26)23-19(27)12-8-16-30(28,29)25-13-5-6-14-25/h2-4,7,9-11,15H,5-6,8,12-14,16H2,1H3,(H,23,27).
What are the key properties of N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-4-pyrrolidin-1-ylsulfonylbutanamide?
N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-4-pyrrolidin-1-ylsulfonylbutanamide has a molecular weight of 426.54 g/mol, XLogP of 3.45, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-4-pyrrolidin-1-ylsulfonylbutanamide is sourced from PubChem (CID 112844900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).