3-(3,4-dimethylphenyl)sulfanyl-N-(6-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)propanamide

C25H25N3OS — CID 18271086

IUPAC3-(3,4-dimethylphenyl)sulfanyl-N-(6-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)propanamide
SMILESCc1ccc2nc(-c3ccccc3)c(NC(=O)CCSc3ccc(C)c(C)c3)n2c1
InChIInChI=1S/C25H25N3OS/c1-17-9-12-22-26-24(20-7-5-4-6-8-20)25(28(22)16-17)27-23(29)13-14-30-21-11-10-18(2)19(3)15-21/h4-12,15-16H,13-14H2,1-3H3,(H,27,29)
InChIKeyGRQNKTYQRRDODY-UHFFFAOYSA-N
MW415.56 g/mol
LogP6.05
Rot. Bonds6

About 3-(3,4-dimethylphenyl)sulfanyl-N-(6-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)propanamide

3-(3,4-dimethylphenyl)sulfanyl-N-(6-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)propanamide (PubChem CID 18271086) has the molecular formula C25H25N3OS and a molecular weight of 415.56 g/mol. Its IUPAC name is 3-(3,4-dimethylphenyl)sulfanyl-N-(6-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)propanamide.

Molecular Properties

Compound Name3-(3,4-dimethylphenyl)sulfanyl-N-(6-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)propanamide
PubChem CID18271086
Molecular FormulaC25H25N3OS
Molecular Weight415.56 g/mol
Exact Mass415.17
IUPAC Name3-(3,4-dimethylphenyl)sulfanyl-N-(6-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)propanamide
SMILESCc1ccc2nc(-c3ccccc3)c(NC(=O)CCSc3ccc(C)c(C)c3)n2c1
InChIInChI=1S/C25H25N3OS/c1-17-9-12-22-26-24(20-7-5-4-6-8-20)25(28(22)16-17)27-23(29)13-14-30-21-11-10-18(2)19(3)15-21/h4-12,15-16H,13-14H2,1-3H3,(H,27,29)
InChIKeyGRQNKTYQRRDODY-UHFFFAOYSA-N
XLogP6.05
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500415.56
LogP ≤ 56.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-(3,4-dimethylphenyl)sulfanyl-N-(6-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)propanamide 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

4-(1,3-benzothiazol-2-ylsulfanyl)-N-(6-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)butanamide
CID 16559405
N-(6-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-2-(2-propoxyphenoxy)acetamide
CID 16559413
2-methoxy-N-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]acetamide
CID 42881672
5-bromo-N-(6-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)pyridine-3-carboxamide
CID 16559398
2-(2-methoxy-4-prop-2-enylphenoxy)-N-(6-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)acetamide
CID 16559418
N-[2-(2-methoxyphenyl)-6-methylimidazo[1,2-a]pyridin-3-yl]pentanamide
CID 42693919
N-(6-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-2-phenoxypropanamide
CID 18272044
N-(6-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-2-(4-nitrophenoxy)acetamide
CID 18225194
ethyl 4-[[2-(4-methoxyphenyl)-6-methylimidazo[1,2-a]pyridin-3-yl]amino]-4-oxobutanoate
CID 42881647
ethyl 2-[(6-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)amino]acetate
CID 808619
3-methyl-N-[6-methyl-2-(2-methylphenyl)imidazo[1,2-a]pyridin-3-yl]butanamide
CID 42694564
N-benzyl-2-(3-hexylsulfanylphenyl)-6-methylimidazo[1,2-a]pyridin-3-amine
CID 24891787

Frequently Asked Questions

What is the IUPAC name of 3-(3,4-dimethylphenyl)sulfanyl-N-(6-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)propanamide?
The IUPAC name of 3-(3,4-dimethylphenyl)sulfanyl-N-(6-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)propanamide (CID 18271086) is 3-(3,4-dimethylphenyl)sulfanyl-N-(6-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)propanamide.
What is the SMILES notation for 3-(3,4-dimethylphenyl)sulfanyl-N-(6-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)propanamide?
The canonical SMILES for 3-(3,4-dimethylphenyl)sulfanyl-N-(6-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)propanamide is Cc1ccc2nc(-c3ccccc3)c(NC(=O)CCSc3ccc(C)c(C)c3)n2c1.
What is the InChIKey of 3-(3,4-dimethylphenyl)sulfanyl-N-(6-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)propanamide?
The InChIKey is GRQNKTYQRRDODY-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H25N3OS/c1-17-9-12-22-26-24(20-7-5-4-6-8-20)25(28(22)16-17)27-23(29)13-14-30-21-11-10-18(2)19(3)15-21/h4-12,15-16H,13-14H2,1-3H3,(H,27,29).
What are the key properties of 3-(3,4-dimethylphenyl)sulfanyl-N-(6-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)propanamide?
3-(3,4-dimethylphenyl)sulfanyl-N-(6-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)propanamide has a molecular weight of 415.56 g/mol, XLogP of 6.05, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3,4-dimethylphenyl)sulfanyl-N-(6-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)propanamide is sourced from PubChem (CID 18271086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).