2-[2-(6-methyl-2-pyridinyl)pyrazol-3-yl]thieno[3,2-c]pyridine

C16H12N4S — CID 24880911

IUPAC2-[2-(6-methyl-2-pyridinyl)pyrazol-3-yl]thieno[3,2-c]pyridine
SMILESCc1cccc(-n2nccc2-c2cc3cnccc3s2)n1
InChIInChI=1S/C16H12N4S/c1-11-3-2-4-16(19-11)20-13(5-8-18-20)15-9-12-10-17-7-6-14(12)21-15/h2-10H,1H3
InChIKeyNTOWMPDTXYCCPD-UHFFFAOYSA-N
MW292.37 g/mol
LogP3.85
Rot. Bonds2

About 2-[2-(6-methyl-2-pyridinyl)pyrazol-3-yl]thieno[3,2-c]pyridine

2-[2-(6-methyl-2-pyridinyl)pyrazol-3-yl]thieno[3,2-c]pyridine (PubChem CID 24880911) has the molecular formula C16H12N4S and a molecular weight of 292.37 g/mol. Its IUPAC name is 2-[2-(6-methyl-2-pyridinyl)pyrazol-3-yl]thieno[3,2-c]pyridine.

Molecular Properties

Compound Name2-[2-(6-methyl-2-pyridinyl)pyrazol-3-yl]thieno[3,2-c]pyridine
PubChem CID24880911
Molecular FormulaC16H12N4S
Molecular Weight292.37 g/mol
Exact Mass292.08
IUPAC Name2-[2-(6-methyl-2-pyridinyl)pyrazol-3-yl]thieno[3,2-c]pyridine
SMILESCc1cccc(-n2nccc2-c2cc3cnccc3s2)n1
InChIInChI=1S/C16H12N4S/c1-11-3-2-4-16(19-11)20-13(5-8-18-20)15-9-12-10-17-7-6-14(12)21-15/h2-10H,1H3
InChIKeyNTOWMPDTXYCCPD-UHFFFAOYSA-N
XLogP3.85
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.37
LogP ≤ 53.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(6-methyl-2-pyridinyl)pyrazol-3-yl]thieno[3,2-c]pyridine?
The IUPAC name of 2-[2-(6-methyl-2-pyridinyl)pyrazol-3-yl]thieno[3,2-c]pyridine (CID 24880911) is 2-[2-(6-methyl-2-pyridinyl)pyrazol-3-yl]thieno[3,2-c]pyridine.
What is the SMILES notation for 2-[2-(6-methyl-2-pyridinyl)pyrazol-3-yl]thieno[3,2-c]pyridine?
The canonical SMILES for 2-[2-(6-methyl-2-pyridinyl)pyrazol-3-yl]thieno[3,2-c]pyridine is Cc1cccc(-n2nccc2-c2cc3cnccc3s2)n1.
What is the InChIKey of 2-[2-(6-methyl-2-pyridinyl)pyrazol-3-yl]thieno[3,2-c]pyridine?
The InChIKey is NTOWMPDTXYCCPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12N4S/c1-11-3-2-4-16(19-11)20-13(5-8-18-20)15-9-12-10-17-7-6-14(12)21-15/h2-10H,1H3.
What are the key properties of 2-[2-(6-methyl-2-pyridinyl)pyrazol-3-yl]thieno[3,2-c]pyridine?
2-[2-(6-methyl-2-pyridinyl)pyrazol-3-yl]thieno[3,2-c]pyridine has a molecular weight of 292.37 g/mol, XLogP of 3.85, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(6-methyl-2-pyridinyl)pyrazol-3-yl]thieno[3,2-c]pyridine is sourced from PubChem (CID 24880911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).