2-[3-[2-(4-methylphenyl)ethyl]thiophen-2-yl]pyridine

C18H17NS — CID 122386358

IUPAC2-[3-[2-(4-methylphenyl)ethyl]thiophen-2-yl]pyridine
SMILESCc1ccc(CCc2ccsc2-c2ccccn2)cc1
InChIInChI=1S/C18H17NS/c1-14-5-7-15(8-6-14)9-10-16-11-13-20-18(16)17-4-2-3-12-19-17/h2-8,11-13H,9-10H2,1H3
InChIKeyICJKAFUVOBLVGQ-UHFFFAOYSA-N
MW279.41 g/mol
LogP4.90
Rot. Bonds4

About 2-[3-[2-(4-methylphenyl)ethyl]thiophen-2-yl]pyridine

2-[3-[2-(4-methylphenyl)ethyl]thiophen-2-yl]pyridine (PubChem CID 122386358) has the molecular formula C18H17NS and a molecular weight of 279.41 g/mol. Its IUPAC name is 2-[3-[2-(4-methylphenyl)ethyl]thiophen-2-yl]pyridine.

Molecular Properties

Compound Name2-[3-[2-(4-methylphenyl)ethyl]thiophen-2-yl]pyridine
PubChem CID122386358
Molecular FormulaC18H17NS
Molecular Weight279.41 g/mol
Exact Mass279.11
IUPAC Name2-[3-[2-(4-methylphenyl)ethyl]thiophen-2-yl]pyridine
SMILESCc1ccc(CCc2ccsc2-c2ccccn2)cc1
InChIInChI=1S/C18H17NS/c1-14-5-7-15(8-6-14)9-10-16-11-13-20-18(16)17-4-2-3-12-19-17/h2-8,11-13H,9-10H2,1H3
InChIKeyICJKAFUVOBLVGQ-UHFFFAOYSA-N
XLogP4.90
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.41
LogP ≤ 54.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-methylphenyl)-2-(2-pyridin-2-ylthiophen-3-yl)ethanone
CID 150487312
4-[2-(4-methylphenyl)ethyl]-2-pyridin-2-yl-1,3-thiazole-5-carboxylic acid
CID 82227065
2-(3-bromothiophen-2-yl)pyridine
CID 15937584
2-[4-(bromomethyl)phenyl]pyridine;2-(4-methylphenyl)pyridine
CID 175312241
3-[2-(4-methylphenyl)ethyl]-4-pyridin-2-yl-1,2-oxazol-5-amine
CID 80521081
2-[2-[2-(4-phenylphenyl)ethyl]phenyl]pyridine
CID 135057697
2-(4-methylphenyl)pyridine;silver
CID 121395993
ethane;2-(4-propylphenyl)pyridine
CID 158701503
iridium;tris(2-[4-(4-methylphenyl)phenyl]pyridine)
CID 173084530
trimethyl-[2-(4-pyridin-2-ylphenyl)ethyl]silane
CID 162513339
(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)methanamine
CID 39240932
N-[(4-methylphenyl)methyl]-N'-[(4-pyridin-2-ylphenyl)methyl]ethane-1,2-diamine
CID 159589094

Frequently Asked Questions

What is the IUPAC name of 2-[3-[2-(4-methylphenyl)ethyl]thiophen-2-yl]pyridine?
The IUPAC name of 2-[3-[2-(4-methylphenyl)ethyl]thiophen-2-yl]pyridine (CID 122386358) is 2-[3-[2-(4-methylphenyl)ethyl]thiophen-2-yl]pyridine.
What is the SMILES notation for 2-[3-[2-(4-methylphenyl)ethyl]thiophen-2-yl]pyridine?
The canonical SMILES for 2-[3-[2-(4-methylphenyl)ethyl]thiophen-2-yl]pyridine is Cc1ccc(CCc2ccsc2-c2ccccn2)cc1.
What is the InChIKey of 2-[3-[2-(4-methylphenyl)ethyl]thiophen-2-yl]pyridine?
The InChIKey is ICJKAFUVOBLVGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17NS/c1-14-5-7-15(8-6-14)9-10-16-11-13-20-18(16)17-4-2-3-12-19-17/h2-8,11-13H,9-10H2,1H3.
What are the key properties of 2-[3-[2-(4-methylphenyl)ethyl]thiophen-2-yl]pyridine?
2-[3-[2-(4-methylphenyl)ethyl]thiophen-2-yl]pyridine has a molecular weight of 279.41 g/mol, XLogP of 4.90, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-[2-(4-methylphenyl)ethyl]thiophen-2-yl]pyridine is sourced from PubChem (CID 122386358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).