4-methyl-2,6-dipropylpyridine

C12H19N — CID 13400495

IUPAC4-methyl-2,6-dipropylpyridine
SMILESCCCc1cc(C)cc(CCC)n1
InChIInChI=1S/C12H19N/c1-4-6-11-8-10(3)9-12(13-11)7-5-2/h8-9H,4-7H2,1-3H3
InChIKeyOARMLPMRBILYCE-UHFFFAOYSA-N
MW177.29 g/mol
LogP3.30
Rot. Bonds4

About 4-methyl-2,6-dipropylpyridine

4-methyl-2,6-dipropylpyridine (PubChem CID 13400495) has the molecular formula C12H19N and a molecular weight of 177.29 g/mol. Its IUPAC name is 4-methyl-2,6-dipropylpyridine.

Molecular Properties

Compound Name4-methyl-2,6-dipropylpyridine
PubChem CID13400495
Molecular FormulaC12H19N
Molecular Weight177.29 g/mol
Exact Mass177.15
IUPAC Name4-methyl-2,6-dipropylpyridine
SMILESCCCc1cc(C)cc(CCC)n1
InChIInChI=1S/C12H19N/c1-4-6-11-8-10(3)9-12(13-11)7-5-2/h8-9H,4-7H2,1-3H3
InChIKeyOARMLPMRBILYCE-UHFFFAOYSA-N
XLogP3.30
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.29
LogP ≤ 53.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 4-methyl-2,6-dipropylpyridine 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 4-methyl-2,6-dipropylpyridine?
The IUPAC name of 4-methyl-2,6-dipropylpyridine (CID 13400495) is 4-methyl-2,6-dipropylpyridine.
What is the SMILES notation for 4-methyl-2,6-dipropylpyridine?
The canonical SMILES for 4-methyl-2,6-dipropylpyridine is CCCc1cc(C)cc(CCC)n1.
What is the InChIKey of 4-methyl-2,6-dipropylpyridine?
The InChIKey is OARMLPMRBILYCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N/c1-4-6-11-8-10(3)9-12(13-11)7-5-2/h8-9H,4-7H2,1-3H3.
What are the key properties of 4-methyl-2,6-dipropylpyridine?
4-methyl-2,6-dipropylpyridine has a molecular weight of 177.29 g/mol, XLogP of 3.30, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2,6-dipropylpyridine is sourced from PubChem (CID 13400495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).