3-methoxy-5-(5-pyridin-3-ylthiophen-2-yl)pyridine

C15H12N2OS — CID 177401684

IUPAC3-methoxy-5-(5-pyridin-3-ylthiophen-2-yl)pyridine
SMILESCOc1cncc(-c2ccc(-c3cccnc3)s2)c1
InChIInChI=1S/C15H12N2OS/c1-18-13-7-12(9-17-10-13)15-5-4-14(19-15)11-3-2-6-16-8-11/h2-10H,1H3
InChIKeyABRPEEHIBMRWER-UHFFFAOYSA-N
MW268.34 g/mol
LogP3.88
Rot. Bonds3

About 3-methoxy-5-(5-pyridin-3-ylthiophen-2-yl)pyridine

3-methoxy-5-(5-pyridin-3-ylthiophen-2-yl)pyridine (PubChem CID 177401684) has the molecular formula C15H12N2OS and a molecular weight of 268.34 g/mol. Its IUPAC name is 3-methoxy-5-(5-pyridin-3-ylthiophen-2-yl)pyridine.

Molecular Properties

Compound Name3-methoxy-5-(5-pyridin-3-ylthiophen-2-yl)pyridine
PubChem CID177401684
Molecular FormulaC15H12N2OS
Molecular Weight268.34 g/mol
Exact Mass268.07
IUPAC Name3-methoxy-5-(5-pyridin-3-ylthiophen-2-yl)pyridine
SMILESCOc1cncc(-c2ccc(-c3cccnc3)s2)c1
InChIInChI=1S/C15H12N2OS/c1-18-13-7-12(9-17-10-13)15-5-4-14(19-15)11-3-2-6-16-8-11/h2-10H,1H3
InChIKeyABRPEEHIBMRWER-UHFFFAOYSA-N
XLogP3.88
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.34
LogP ≤ 53.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

3-[5-[5-[5-(5-pyridin-3-ylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]pyridine
CID 102393188
2-(3-methoxyphenyl)-5-pyridin-3-yl-1,3,4-oxadiazole
CID 25054364
5-pyridin-3-ylthiophene-2-thiol
CID 164530684
3-(furan-2-yl)-5-methoxypyridine
CID 174589333
3-[4-(5-methylthiophen-2-yl)phenyl]pyridine
CID 130309277
3-(2,4-dimethoxyphenyl)pyridine
CID 46316965
4-(5-methoxy-3-pyridinyl)pyridin-2-amine
CID 104877368
4-chloro-6-(5-methoxy-3-pyridinyl)-2-pyridin-3-ylquinazoline
CID 89417196
3-(2,5-dimethoxy-4-pyridin-3-ylphenyl)pyridine
CID 156631933
6-(5-methoxy-3-pyridinyl)pyridin-2-amine
CID 39834222
4-methoxy-2-pyridin-3-ylaniline
CID 71445761
6-(5-methoxy-3-pyridinyl)-N-methyl-2-pyridin-3-ylquinazolin-4-amine
CID 71179842

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-5-(5-pyridin-3-ylthiophen-2-yl)pyridine?
The IUPAC name of 3-methoxy-5-(5-pyridin-3-ylthiophen-2-yl)pyridine (CID 177401684) is 3-methoxy-5-(5-pyridin-3-ylthiophen-2-yl)pyridine.
What is the SMILES notation for 3-methoxy-5-(5-pyridin-3-ylthiophen-2-yl)pyridine?
The canonical SMILES for 3-methoxy-5-(5-pyridin-3-ylthiophen-2-yl)pyridine is COc1cncc(-c2ccc(-c3cccnc3)s2)c1.
What is the InChIKey of 3-methoxy-5-(5-pyridin-3-ylthiophen-2-yl)pyridine?
The InChIKey is ABRPEEHIBMRWER-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N2OS/c1-18-13-7-12(9-17-10-13)15-5-4-14(19-15)11-3-2-6-16-8-11/h2-10H,1H3.
What are the key properties of 3-methoxy-5-(5-pyridin-3-ylthiophen-2-yl)pyridine?
3-methoxy-5-(5-pyridin-3-ylthiophen-2-yl)pyridine has a molecular weight of 268.34 g/mol, XLogP of 3.88, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-5-(5-pyridin-3-ylthiophen-2-yl)pyridine is sourced from PubChem (CID 177401684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).