3-methyl-4-(5-methylthiophen-2-yl)pyridine

C11H11NS — CID 163257476

IUPAC3-methyl-4-(5-methylthiophen-2-yl)pyridine
SMILESCc1ccc(-c2ccncc2C)s1
InChIInChI=1S/C11H11NS/c1-8-7-12-6-5-10(8)11-4-3-9(2)13-11/h3-7H,1-2H3
InChIKeyROWREZBKQKPBSY-UHFFFAOYSA-N
MW189.28 g/mol
LogP3.43
Rot. Bonds1

About 3-methyl-4-(5-methylthiophen-2-yl)pyridine

3-methyl-4-(5-methylthiophen-2-yl)pyridine (PubChem CID 163257476) has the molecular formula C11H11NS and a molecular weight of 189.28 g/mol. Its IUPAC name is 3-methyl-4-(5-methylthiophen-2-yl)pyridine.

Molecular Properties

Compound Name3-methyl-4-(5-methylthiophen-2-yl)pyridine
PubChem CID163257476
Molecular FormulaC11H11NS
Molecular Weight189.28 g/mol
Exact Mass189.06
IUPAC Name3-methyl-4-(5-methylthiophen-2-yl)pyridine
SMILESCc1ccc(-c2ccncc2C)s1
InChIInChI=1S/C11H11NS/c1-8-7-12-6-5-10(8)11-4-3-9(2)13-11/h3-7H,1-2H3
InChIKeyROWREZBKQKPBSY-UHFFFAOYSA-N
XLogP3.43
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.28
LogP ≤ 53.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

[5-(3-methyl-4-pyridinyl)thiophen-2-yl]methanamine
CID 66279048
3-methyl-4-(2-methylphenyl)pyridine
CID 130153052
N-(4-fluorophenyl)-5-(3-methyl-4-pyridinyl)thiophene-2-carboxamide
CID 166218181
ethane;2-methyl-5-(5-methylthiophen-2-yl)thiophene
CID 91463281
2-(3-methyl-4-pyridinyl)-1,3-thiazol-4-amine
CID 83108842
5,8-bis(5-methylthiophen-2-yl)quinoxaline
CID 58982512
4-[5-(5-methylthiophen-2-yl)thiophen-2-yl]pyridine
CID 23386720
3-[4-(5-methylthiophen-2-yl)phenyl]pyridine
CID 130309277
2-chloro-6-methyl-3-(3-methyl-4-pyridinyl)pyridine
CID 175089483
6-(3-methyl-4-pyridinyl)-1H-pyrazine-2-thione
CID 106518852
4-(5-methyl-1,3-thiazol-2-yl)pyridin-3-amine
CID 82403303
1-methyl-2-(3-methyl-4-pyridinyl)pyrazin-1-ium
CID 155790399

Frequently Asked Questions

What is the IUPAC name of 3-methyl-4-(5-methylthiophen-2-yl)pyridine?
The IUPAC name of 3-methyl-4-(5-methylthiophen-2-yl)pyridine (CID 163257476) is 3-methyl-4-(5-methylthiophen-2-yl)pyridine.
What is the SMILES notation for 3-methyl-4-(5-methylthiophen-2-yl)pyridine?
The canonical SMILES for 3-methyl-4-(5-methylthiophen-2-yl)pyridine is Cc1ccc(-c2ccncc2C)s1.
What is the InChIKey of 3-methyl-4-(5-methylthiophen-2-yl)pyridine?
The InChIKey is ROWREZBKQKPBSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11NS/c1-8-7-12-6-5-10(8)11-4-3-9(2)13-11/h3-7H,1-2H3.
What are the key properties of 3-methyl-4-(5-methylthiophen-2-yl)pyridine?
3-methyl-4-(5-methylthiophen-2-yl)pyridine has a molecular weight of 189.28 g/mol, XLogP of 3.43, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-4-(5-methylthiophen-2-yl)pyridine is sourced from PubChem (CID 163257476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).