3-(3-imidazo[1,2-a]pyridin-6-yl-2-pyridinyl)-N-methylsulfanylaniline

C19H16N4S — CID 144943671

IUPAC3-(3-imidazo[1,2-a]pyridin-6-yl-2-pyridinyl)-N-methylsulfanylaniline
SMILESCSNc1cccc(-c2ncccc2-c2ccc3nccn3c2)c1
InChIInChI=1S/C19H16N4S/c1-24-22-16-5-2-4-14(12-16)19-17(6-3-9-21-19)15-7-8-18-20-10-11-23(18)13-15/h2-13,22H,1H3
InChIKeyMPLUKGANYSTANV-UHFFFAOYSA-N
MW332.43 g/mol
LogP4.75
Rot. Bonds4

About 3-(3-imidazo[1,2-a]pyridin-6-yl-2-pyridinyl)-N-methylsulfanylaniline

3-(3-imidazo[1,2-a]pyridin-6-yl-2-pyridinyl)-N-methylsulfanylaniline (PubChem CID 144943671) has the molecular formula C19H16N4S and a molecular weight of 332.43 g/mol. Its IUPAC name is 3-(3-imidazo[1,2-a]pyridin-6-yl-2-pyridinyl)-N-methylsulfanylaniline.

Molecular Properties

Compound Name3-(3-imidazo[1,2-a]pyridin-6-yl-2-pyridinyl)-N-methylsulfanylaniline
PubChem CID144943671
Molecular FormulaC19H16N4S
Molecular Weight332.43 g/mol
Exact Mass332.11
IUPAC Name3-(3-imidazo[1,2-a]pyridin-6-yl-2-pyridinyl)-N-methylsulfanylaniline
SMILESCSNc1cccc(-c2ncccc2-c2ccc3nccn3c2)c1
InChIInChI=1S/C19H16N4S/c1-24-22-16-5-2-4-14(12-16)19-17(6-3-9-21-19)15-7-8-18-20-10-11-23(18)13-15/h2-13,22H,1H3
InChIKeyMPLUKGANYSTANV-UHFFFAOYSA-N
XLogP4.75
TPSA42.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.43
LogP ≤ 54.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'sulphur_nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 3-(3-imidazo[1,2-a]pyridin-6-yl-2-pyridinyl)-N-methylsulfanylaniline 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

6-(2-chloro-3-pyridinyl)imidazo[1,2-a]pyridine
CID 86715478
2-imidazo[1,2-a]pyridin-6-yl-N,N-dimethylaniline
CID 122418001
6-(4-methylsulfanylphenyl)imidazo[1,2-a]pyridine
CID 23629220
N-ethyl-2-(3-imidazo[1,2-a]pyridin-6-ylphenyl)propan-2-amine
CID 164536311
6-dibenzofuran-4-ylimidazo[1,2-a]pyridine
CID 46942694
7-chloro-6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,2-a]pyridine
CID 90096306
6-[2-methyl-3-[(1E,3E)-penta-1,3-dienyl]phenyl]imidazo[1,2-a]pyridine
CID 167089405
3-[(E)-2-(3-imidazo[1,2-a]pyridin-6-yl-2-methylphenyl)ethenyl]-4-methylbenzaldehyde
CID 159622560
ethane;[3-(4-fluoro-3-methylphenyl)-4-imidazo[1,2-a]pyridin-6-ylpyrazol-1-yl] thiohypofluorite
CID 145448799
1-[6-[2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]imidazo[1,2-a]pyridin-3-yl]ethanone
CID 90095601
3-(3-methyl-2-pyridinyl)-N-[3-(3-methyl-2-pyridinyl)phenyl]aniline
CID 90070817
6-imidazo[1,2-a]pyridin-6-yl-7-phenyl-1H-1,8-naphthyridin-4-one
CID 154604829

Frequently Asked Questions

What is the IUPAC name of 3-(3-imidazo[1,2-a]pyridin-6-yl-2-pyridinyl)-N-methylsulfanylaniline?
The IUPAC name of 3-(3-imidazo[1,2-a]pyridin-6-yl-2-pyridinyl)-N-methylsulfanylaniline (CID 144943671) is 3-(3-imidazo[1,2-a]pyridin-6-yl-2-pyridinyl)-N-methylsulfanylaniline.
What is the SMILES notation for 3-(3-imidazo[1,2-a]pyridin-6-yl-2-pyridinyl)-N-methylsulfanylaniline?
The canonical SMILES for 3-(3-imidazo[1,2-a]pyridin-6-yl-2-pyridinyl)-N-methylsulfanylaniline is CSNc1cccc(-c2ncccc2-c2ccc3nccn3c2)c1.
What is the InChIKey of 3-(3-imidazo[1,2-a]pyridin-6-yl-2-pyridinyl)-N-methylsulfanylaniline?
The InChIKey is MPLUKGANYSTANV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N4S/c1-24-22-16-5-2-4-14(12-16)19-17(6-3-9-21-19)15-7-8-18-20-10-11-23(18)13-15/h2-13,22H,1H3.
What are the key properties of 3-(3-imidazo[1,2-a]pyridin-6-yl-2-pyridinyl)-N-methylsulfanylaniline?
3-(3-imidazo[1,2-a]pyridin-6-yl-2-pyridinyl)-N-methylsulfanylaniline has a molecular weight of 332.43 g/mol, XLogP of 4.75, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-imidazo[1,2-a]pyridin-6-yl-2-pyridinyl)-N-methylsulfanylaniline is sourced from PubChem (CID 144943671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).