5-methyl-N-(2-methylsulfanylphenyl)furo[3,2-b]pyridine-2-carboxamide

C16H14N2O2S — CID 16906974

IUPAC5-methyl-N-(2-methylsulfanylphenyl)furo[3,2-b]pyridine-2-carboxamide
SMILESCSc1ccccc1NC(=O)c1cc2nc(C)ccc2o1
InChIInChI=1S/C16H14N2O2S/c1-10-7-8-13-12(17-10)9-14(20-13)16(19)18-11-5-3-4-6-15(11)21-2/h3-9H,1-2H3,(H,18,19)
InChIKeyAGLJISBJWYTVDT-UHFFFAOYSA-N
MW298.37 g/mol
LogP4.11
Rot. Bonds3

About 5-methyl-N-(2-methylsulfanylphenyl)furo[3,2-b]pyridine-2-carboxamide

5-methyl-N-(2-methylsulfanylphenyl)furo[3,2-b]pyridine-2-carboxamide (PubChem CID 16906974) has the molecular formula C16H14N2O2S and a molecular weight of 298.37 g/mol. Its IUPAC name is 5-methyl-N-(2-methylsulfanylphenyl)furo[3,2-b]pyridine-2-carboxamide.

Molecular Properties

Compound Name5-methyl-N-(2-methylsulfanylphenyl)furo[3,2-b]pyridine-2-carboxamide
PubChem CID16906974
Molecular FormulaC16H14N2O2S
Molecular Weight298.37 g/mol
Exact Mass298.08
IUPAC Name5-methyl-N-(2-methylsulfanylphenyl)furo[3,2-b]pyridine-2-carboxamide
SMILESCSc1ccccc1NC(=O)c1cc2nc(C)ccc2o1
InChIInChI=1S/C16H14N2O2S/c1-10-7-8-13-12(17-10)9-14(20-13)16(19)18-11-5-3-4-6-15(11)21-2/h3-9H,1-2H3,(H,18,19)
InChIKeyAGLJISBJWYTVDT-UHFFFAOYSA-N
XLogP4.11
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.37
LogP ≤ 54.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-methyl-N-(2-methylsulfanylphenyl)furo[3,2-b]pyridine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-(2-methylsulfanylphenyl)furo[3,2-b]pyridine-2-carboxamide?
The IUPAC name of 5-methyl-N-(2-methylsulfanylphenyl)furo[3,2-b]pyridine-2-carboxamide (CID 16906974) is 5-methyl-N-(2-methylsulfanylphenyl)furo[3,2-b]pyridine-2-carboxamide.
What is the SMILES notation for 5-methyl-N-(2-methylsulfanylphenyl)furo[3,2-b]pyridine-2-carboxamide?
The canonical SMILES for 5-methyl-N-(2-methylsulfanylphenyl)furo[3,2-b]pyridine-2-carboxamide is CSc1ccccc1NC(=O)c1cc2nc(C)ccc2o1.
What is the InChIKey of 5-methyl-N-(2-methylsulfanylphenyl)furo[3,2-b]pyridine-2-carboxamide?
The InChIKey is AGLJISBJWYTVDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O2S/c1-10-7-8-13-12(17-10)9-14(20-13)16(19)18-11-5-3-4-6-15(11)21-2/h3-9H,1-2H3,(H,18,19).
What are the key properties of 5-methyl-N-(2-methylsulfanylphenyl)furo[3,2-b]pyridine-2-carboxamide?
5-methyl-N-(2-methylsulfanylphenyl)furo[3,2-b]pyridine-2-carboxamide has a molecular weight of 298.37 g/mol, XLogP of 4.11, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-(2-methylsulfanylphenyl)furo[3,2-b]pyridine-2-carboxamide is sourced from PubChem (CID 16906974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).