1-[2-(3-methylphenyl)sulfanylimidazo[1,2-a]pyridin-3-yl]propan-2-amine

C17H19N3S — CID 63818522

IUPAC1-[2-(3-methylphenyl)sulfanylimidazo[1,2-a]pyridin-3-yl]propan-2-amine
SMILESCc1cccc(Sc2nc3ccccn3c2CC(C)N)c1
InChIInChI=1S/C17H19N3S/c1-12-6-5-7-14(10-12)21-17-15(11-13(2)18)20-9-4-3-8-16(20)19-17/h3-10,13H,11,18H2,1-2H3
InChIKeyFEFIXWCUXPWHAO-UHFFFAOYSA-N
MW297.43 g/mol
LogP3.68
Rot. Bonds4

About 1-[2-(3-methylphenyl)sulfanylimidazo[1,2-a]pyridin-3-yl]propan-2-amine

1-[2-(3-methylphenyl)sulfanylimidazo[1,2-a]pyridin-3-yl]propan-2-amine (PubChem CID 63818522) has the molecular formula C17H19N3S and a molecular weight of 297.43 g/mol. Its IUPAC name is 1-[2-(3-methylphenyl)sulfanylimidazo[1,2-a]pyridin-3-yl]propan-2-amine.

Molecular Properties

Compound Name1-[2-(3-methylphenyl)sulfanylimidazo[1,2-a]pyridin-3-yl]propan-2-amine
PubChem CID63818522
Molecular FormulaC17H19N3S
Molecular Weight297.43 g/mol
Exact Mass297.13
IUPAC Name1-[2-(3-methylphenyl)sulfanylimidazo[1,2-a]pyridin-3-yl]propan-2-amine
SMILESCc1cccc(Sc2nc3ccccn3c2CC(C)N)c1
InChIInChI=1S/C17H19N3S/c1-12-6-5-7-14(10-12)21-17-15(11-13(2)18)20-9-4-3-8-16(20)19-17/h3-10,13H,11,18H2,1-2H3
InChIKeyFEFIXWCUXPWHAO-UHFFFAOYSA-N
XLogP3.68
TPSA43.32 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.43
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-[2-(3-methylphenyl)sulfanylimidazo[1,2-a]pyridin-3-yl]propan-2-amine 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

1-[2-(2-methylphenyl)sulfanylimidazo[1,2-a]pyridin-3-yl]propan-2-amine
CID 63818822
1-[2-(1-methyltetrazol-5-yl)sulfanylimidazo[1,2-a]pyridin-3-yl]propan-2-amine
CID 63819265
[2-(4-methylphenyl)sulfanylimidazo[1,2-a]pyridin-3-yl]methanamine
CID 63806284
1-(2-butylsulfanylimidazo[1,2-a]pyridin-3-yl)propan-2-amine
CID 63819837
2-[2-(3-chlorophenyl)sulfanylimidazo[1,2-a]pyridin-3-yl]ethanamine
CID 63818326
1-[2-(3-chlorophenyl)sulfanylimidazo[1,2-a]pyridin-3-yl]-N-methylmethanamine
CID 63808260
[2-(2,4-dimethylphenyl)sulfanylimidazo[1,2-a]pyridin-3-yl]methanol
CID 63812601
[2-(3,4-difluorophenyl)sulfanylimidazo[1,2-a]pyridin-3-yl]methanamine
CID 63809922
1-(2-tert-butylsulfanylimidazo[1,2-a]pyridin-3-yl)butan-2-amine
CID 55237980
[2-(4,5,6-trimethylpyrimidin-2-yl)sulfanylimidazo[1,2-a]pyridin-3-yl]methanamine
CID 65041191
[2-[(4,6-dimethyl-2-pyridinyl)sulfanyl]imidazo[1,2-a]pyridin-3-yl]methanol
CID 102926184
[2-(2,5-dimethylpyrazol-3-yl)sulfanylimidazo[1,2-a]pyridin-3-yl]methanamine
CID 63809693

Frequently Asked Questions

What is the IUPAC name of 1-[2-(3-methylphenyl)sulfanylimidazo[1,2-a]pyridin-3-yl]propan-2-amine?
The IUPAC name of 1-[2-(3-methylphenyl)sulfanylimidazo[1,2-a]pyridin-3-yl]propan-2-amine (CID 63818522) is 1-[2-(3-methylphenyl)sulfanylimidazo[1,2-a]pyridin-3-yl]propan-2-amine.
What is the SMILES notation for 1-[2-(3-methylphenyl)sulfanylimidazo[1,2-a]pyridin-3-yl]propan-2-amine?
The canonical SMILES for 1-[2-(3-methylphenyl)sulfanylimidazo[1,2-a]pyridin-3-yl]propan-2-amine is Cc1cccc(Sc2nc3ccccn3c2CC(C)N)c1.
What is the InChIKey of 1-[2-(3-methylphenyl)sulfanylimidazo[1,2-a]pyridin-3-yl]propan-2-amine?
The InChIKey is FEFIXWCUXPWHAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3S/c1-12-6-5-7-14(10-12)21-17-15(11-13(2)18)20-9-4-3-8-16(20)19-17/h3-10,13H,11,18H2,1-2H3.
What are the key properties of 1-[2-(3-methylphenyl)sulfanylimidazo[1,2-a]pyridin-3-yl]propan-2-amine?
1-[2-(3-methylphenyl)sulfanylimidazo[1,2-a]pyridin-3-yl]propan-2-amine has a molecular weight of 297.43 g/mol, XLogP of 3.68, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(3-methylphenyl)sulfanylimidazo[1,2-a]pyridin-3-yl]propan-2-amine is sourced from PubChem (CID 63818522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).