ethane;3-(2-methylsulfanylpyrimidin-4-yl)pyrazolo[1,5-a]pyridine

C16H22N4S — CID 91440821

IUPACethane;3-(2-methylsulfanylpyrimidin-4-yl)pyrazolo[1,5-a]pyridine
SMILESCC.CC.CSc1nccc(-c2cnn3ccccc23)n1
InChIInChI=1S/C12H10N4S.2C2H6/c1-17-12-13-6-5-10(15-12)9-8-14-16-7-3-2-4-11(9)16;2*1-2/h2-8H,1H3;2*1-2H3
InChIKeyHKNDQJZXYGCHHS-UHFFFAOYSA-N
MW302.45 g/mol
LogP4.57
Rot. Bonds2

About ethane;3-(2-methylsulfanylpyrimidin-4-yl)pyrazolo[1,5-a]pyridine

ethane;3-(2-methylsulfanylpyrimidin-4-yl)pyrazolo[1,5-a]pyridine (PubChem CID 91440821) has the molecular formula C16H22N4S and a molecular weight of 302.45 g/mol. Its IUPAC name is ethane;3-(2-methylsulfanylpyrimidin-4-yl)pyrazolo[1,5-a]pyridine.

Molecular Properties

Compound Nameethane;3-(2-methylsulfanylpyrimidin-4-yl)pyrazolo[1,5-a]pyridine
PubChem CID91440821
Molecular FormulaC16H22N4S
Molecular Weight302.45 g/mol
Exact Mass302.16
IUPAC Nameethane;3-(2-methylsulfanylpyrimidin-4-yl)pyrazolo[1,5-a]pyridine
SMILESCC.CC.CSc1nccc(-c2cnn3ccccc23)n1
InChIInChI=1S/C12H10N4S.2C2H6/c1-17-12-13-6-5-10(15-12)9-8-14-16-7-3-2-4-11(9)16;2*1-2/h2-8H,1H3;2*1-2H3
InChIKeyHKNDQJZXYGCHHS-UHFFFAOYSA-N
XLogP4.57
TPSA43.08 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.45
LogP ≤ 54.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze ethane;3-(2-methylsulfanylpyrimidin-4-yl)pyrazolo[1,5-a]pyridine 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-(2-methylphenyl)-2-methylsulfanylpyrimidine
CID 71185326
4-(2-chlorophenyl)-2-methylsulfanylpyrimidine
CID 57263424
3-(6-methylpyridazin-3-yl)pyrazolo[1,5-a]pyridine
CID 121014681
3-[6-(1-methylpiperidin-4-yl)-2-pyridinyl]pyrazolo[1,5-a]pyridine
CID 175682012
3-[(4-pyrazolo[1,5-a]pyridin-3-ylpyrimidin-2-yl)amino]benzonitrile
CID 155552177
4-(2,6-dimethyl-3-pyridinyl)-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)pyrimidin-2-amine
CID 56867973
[2-(2-methylsulfanylpyrimidin-4-yl)phenyl]methanol
CID 56722954
4-pyrazolo[1,5-a]pyridin-3-yl-1,3-thiazol-2-amine
CID 103123806
2-methyl-7-(2-methylsulfanylpyrimidin-4-yl)cyclohepta-2,4,6-trien-1-one
CID 174169434
6-pyrazolo[1,5-a]pyridin-3-yl-N-pyridin-3-ylpyridin-2-amine
CID 67372518
4-(5-chloro-1H-pyrazol-4-yl)-2-methylsulfanylpyrimidine
CID 121232259
N-[3-(2-chloroethoxy)phenyl]-4-pyrazolo[1,5-a]pyridin-3-ylpyrimidin-2-amine
CID 141174304

Frequently Asked Questions

What is the IUPAC name of ethane;3-(2-methylsulfanylpyrimidin-4-yl)pyrazolo[1,5-a]pyridine?
The IUPAC name of ethane;3-(2-methylsulfanylpyrimidin-4-yl)pyrazolo[1,5-a]pyridine (CID 91440821) is ethane;3-(2-methylsulfanylpyrimidin-4-yl)pyrazolo[1,5-a]pyridine.
What is the SMILES notation for ethane;3-(2-methylsulfanylpyrimidin-4-yl)pyrazolo[1,5-a]pyridine?
The canonical SMILES for ethane;3-(2-methylsulfanylpyrimidin-4-yl)pyrazolo[1,5-a]pyridine is CC.CC.CSc1nccc(-c2cnn3ccccc23)n1.
What is the InChIKey of ethane;3-(2-methylsulfanylpyrimidin-4-yl)pyrazolo[1,5-a]pyridine?
The InChIKey is HKNDQJZXYGCHHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10N4S.2C2H6/c1-17-12-13-6-5-10(15-12)9-8-14-16-7-3-2-4-11(9)16;2*1-2/h2-8H,1H3;2*1-2H3.
What are the key properties of ethane;3-(2-methylsulfanylpyrimidin-4-yl)pyrazolo[1,5-a]pyridine?
ethane;3-(2-methylsulfanylpyrimidin-4-yl)pyrazolo[1,5-a]pyridine has a molecular weight of 302.45 g/mol, XLogP of 4.57, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;3-(2-methylsulfanylpyrimidin-4-yl)pyrazolo[1,5-a]pyridine is sourced from PubChem (CID 91440821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).