2-[(Z)-but-2-en-2-yl]-3-methyl-5-(5-methylthiophen-2-yl)pyridine

C15H17NS — CID 146292667

IUPAC2-[(Z)-but-2-en-2-yl]-3-methyl-5-(5-methylthiophen-2-yl)pyridine
SMILESC/C=C(/C)c1ncc(-c2ccc(C)s2)cc1C
InChIInChI=1S/C15H17NS/c1-5-10(2)15-11(3)8-13(9-16-15)14-7-6-12(4)17-14/h5-9H,1-4H3/b10-5-
InChIKeyNGPCIOXRFLVUSO-YHYXMXQVSA-N
MW243.37 g/mol
LogP4.85
Rot. Bonds2

About 2-[(Z)-but-2-en-2-yl]-3-methyl-5-(5-methylthiophen-2-yl)pyridine

2-[(Z)-but-2-en-2-yl]-3-methyl-5-(5-methylthiophen-2-yl)pyridine (PubChem CID 146292667) has the molecular formula C15H17NS and a molecular weight of 243.37 g/mol. Its IUPAC name is 2-[(Z)-but-2-en-2-yl]-3-methyl-5-(5-methylthiophen-2-yl)pyridine.

Molecular Properties

Compound Name2-[(Z)-but-2-en-2-yl]-3-methyl-5-(5-methylthiophen-2-yl)pyridine
PubChem CID146292667
Molecular FormulaC15H17NS
Molecular Weight243.37 g/mol
Exact Mass243.11
IUPAC Name2-[(Z)-but-2-en-2-yl]-3-methyl-5-(5-methylthiophen-2-yl)pyridine
SMILESC/C=C(/C)c1ncc(-c2ccc(C)s2)cc1C
InChIInChI=1S/C15H17NS/c1-5-10(2)15-11(3)8-13(9-16-15)14-7-6-12(4)17-14/h5-9H,1-4H3/b10-5-
InChIKeyNGPCIOXRFLVUSO-YHYXMXQVSA-N
XLogP4.85
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.37
LogP ≤ 54.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[(Z)-but-2-en-2-yl]-3-methyl-5-(5-methylthiophen-2-yl)pyridine?
The IUPAC name of 2-[(Z)-but-2-en-2-yl]-3-methyl-5-(5-methylthiophen-2-yl)pyridine (CID 146292667) is 2-[(Z)-but-2-en-2-yl]-3-methyl-5-(5-methylthiophen-2-yl)pyridine.
What is the SMILES notation for 2-[(Z)-but-2-en-2-yl]-3-methyl-5-(5-methylthiophen-2-yl)pyridine?
The canonical SMILES for 2-[(Z)-but-2-en-2-yl]-3-methyl-5-(5-methylthiophen-2-yl)pyridine is C/C=C(/C)c1ncc(-c2ccc(C)s2)cc1C.
What is the InChIKey of 2-[(Z)-but-2-en-2-yl]-3-methyl-5-(5-methylthiophen-2-yl)pyridine?
The InChIKey is NGPCIOXRFLVUSO-YHYXMXQVSA-N. The full InChI is InChI=1S/C15H17NS/c1-5-10(2)15-11(3)8-13(9-16-15)14-7-6-12(4)17-14/h5-9H,1-4H3/b10-5-.
What are the key properties of 2-[(Z)-but-2-en-2-yl]-3-methyl-5-(5-methylthiophen-2-yl)pyridine?
2-[(Z)-but-2-en-2-yl]-3-methyl-5-(5-methylthiophen-2-yl)pyridine has a molecular weight of 243.37 g/mol, XLogP of 4.85, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(Z)-but-2-en-2-yl]-3-methyl-5-(5-methylthiophen-2-yl)pyridine is sourced from PubChem (CID 146292667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).