6-ethyl-3-methylpyridine-2-carbonitrile

C9H10N2 — CID 139882538

IUPAC6-ethyl-3-methylpyridine-2-carbonitrile
SMILESCCc1ccc(C)c(C#N)n1
InChIInChI=1S/C9H10N2/c1-3-8-5-4-7(2)9(6-10)11-8/h4-5H,3H2,1-2H3
InChIKeyJEWMXEALYCENSD-UHFFFAOYSA-N
MW146.19 g/mol
LogP1.82
Rot. Bonds1

About 6-ethyl-3-methylpyridine-2-carbonitrile

6-ethyl-3-methylpyridine-2-carbonitrile (PubChem CID 139882538) has the molecular formula C9H10N2 and a molecular weight of 146.19 g/mol. Its IUPAC name is 6-ethyl-3-methylpyridine-2-carbonitrile.

Molecular Properties

Compound Name6-ethyl-3-methylpyridine-2-carbonitrile
PubChem CID139882538
Molecular FormulaC9H10N2
Molecular Weight146.19 g/mol
Exact Mass146.08
IUPAC Name6-ethyl-3-methylpyridine-2-carbonitrile
SMILESCCc1ccc(C)c(C#N)n1
InChIInChI=1S/C9H10N2/c1-3-8-5-4-7(2)9(6-10)11-8/h4-5H,3H2,1-2H3
InChIKeyJEWMXEALYCENSD-UHFFFAOYSA-N
XLogP1.82
TPSA36.68 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.19
LogP ≤ 51.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 6-ethyl-3-methylpyridine-2-carbonitrile with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-ethyl-3-methylpyridine-2-carbonitrile?
The IUPAC name of 6-ethyl-3-methylpyridine-2-carbonitrile (CID 139882538) is 6-ethyl-3-methylpyridine-2-carbonitrile.
What is the SMILES notation for 6-ethyl-3-methylpyridine-2-carbonitrile?
The canonical SMILES for 6-ethyl-3-methylpyridine-2-carbonitrile is CCc1ccc(C)c(C#N)n1.
What is the InChIKey of 6-ethyl-3-methylpyridine-2-carbonitrile?
The InChIKey is JEWMXEALYCENSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2/c1-3-8-5-4-7(2)9(6-10)11-8/h4-5H,3H2,1-2H3.
What are the key properties of 6-ethyl-3-methylpyridine-2-carbonitrile?
6-ethyl-3-methylpyridine-2-carbonitrile has a molecular weight of 146.19 g/mol, XLogP of 1.82, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-3-methylpyridine-2-carbonitrile is sourced from PubChem (CID 139882538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).