2-chloro-4-methyl-6-thiophen-2-ylpyridine

C10H8ClNS — CID 142254642

IUPAC2-chloro-4-methyl-6-thiophen-2-ylpyridine
SMILESCc1cc(Cl)nc(-c2cccs2)c1
InChIInChI=1S/C10H8ClNS/c1-7-5-8(12-10(11)6-7)9-3-2-4-13-9/h2-6H,1H3
InChIKeyXVMVZIRLPAXDDP-UHFFFAOYSA-N
MW209.70 g/mol
LogP3.77
Rot. Bonds1

About 2-chloro-4-methyl-6-thiophen-2-ylpyridine

2-chloro-4-methyl-6-thiophen-2-ylpyridine (PubChem CID 142254642) has the molecular formula C10H8ClNS and a molecular weight of 209.70 g/mol. Its IUPAC name is 2-chloro-4-methyl-6-thiophen-2-ylpyridine.

Molecular Properties

Compound Name2-chloro-4-methyl-6-thiophen-2-ylpyridine
PubChem CID142254642
Molecular FormulaC10H8ClNS
Molecular Weight209.70 g/mol
Exact Mass209.01
IUPAC Name2-chloro-4-methyl-6-thiophen-2-ylpyridine
SMILESCc1cc(Cl)nc(-c2cccs2)c1
InChIInChI=1S/C10H8ClNS/c1-7-5-8(12-10(11)6-7)9-3-2-4-13-9/h2-6H,1H3
InChIKeyXVMVZIRLPAXDDP-UHFFFAOYSA-N
XLogP3.77
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.70
LogP ≤ 53.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-4-methyl-6-thiophen-2-ylpyridine?
The IUPAC name of 2-chloro-4-methyl-6-thiophen-2-ylpyridine (CID 142254642) is 2-chloro-4-methyl-6-thiophen-2-ylpyridine.
What is the SMILES notation for 2-chloro-4-methyl-6-thiophen-2-ylpyridine?
The canonical SMILES for 2-chloro-4-methyl-6-thiophen-2-ylpyridine is Cc1cc(Cl)nc(-c2cccs2)c1.
What is the InChIKey of 2-chloro-4-methyl-6-thiophen-2-ylpyridine?
The InChIKey is XVMVZIRLPAXDDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8ClNS/c1-7-5-8(12-10(11)6-7)9-3-2-4-13-9/h2-6H,1H3.
What are the key properties of 2-chloro-4-methyl-6-thiophen-2-ylpyridine?
2-chloro-4-methyl-6-thiophen-2-ylpyridine has a molecular weight of 209.70 g/mol, XLogP of 3.77, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-4-methyl-6-thiophen-2-ylpyridine is sourced from PubChem (CID 142254642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).