3,5-diethyl-1-methyl-2-propyl-2H-pyridine

C13H23N — CID 23344437

IUPAC3,5-diethyl-1-methyl-2-propyl-2H-pyridine
SMILESCCCC1C(CC)=CC(CC)=CN1C
InChIInChI=1S/C13H23N/c1-5-8-13-12(7-3)9-11(6-2)10-14(13)4/h9-10,13H,5-8H2,1-4H3
InChIKeyFGOVBBPABCSRIG-UHFFFAOYSA-N
MW193.33 g/mol
LogP3.73
Rot. Bonds4

About 3,5-diethyl-1-methyl-2-propyl-2H-pyridine

3,5-diethyl-1-methyl-2-propyl-2H-pyridine (PubChem CID 23344437) has the molecular formula C13H23N and a molecular weight of 193.33 g/mol. Its IUPAC name is 3,5-diethyl-1-methyl-2-propyl-2H-pyridine.

Molecular Properties

Compound Name3,5-diethyl-1-methyl-2-propyl-2H-pyridine
PubChem CID23344437
Molecular FormulaC13H23N
Molecular Weight193.33 g/mol
Exact Mass193.18
IUPAC Name3,5-diethyl-1-methyl-2-propyl-2H-pyridine
SMILESCCCC1C(CC)=CC(CC)=CN1C
InChIInChI=1S/C13H23N/c1-5-8-13-12(7-3)9-11(6-2)10-14(13)4/h9-10,13H,5-8H2,1-4H3
InChIKeyFGOVBBPABCSRIG-UHFFFAOYSA-N
XLogP3.73
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.33
LogP ≤ 53.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 3,5-diethyl-1-methyl-2-propyl-2H-pyridine 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 3,5-diethyl-1-methyl-2-propyl-2H-pyridine?
The IUPAC name of 3,5-diethyl-1-methyl-2-propyl-2H-pyridine (CID 23344437) is 3,5-diethyl-1-methyl-2-propyl-2H-pyridine.
What is the SMILES notation for 3,5-diethyl-1-methyl-2-propyl-2H-pyridine?
The canonical SMILES for 3,5-diethyl-1-methyl-2-propyl-2H-pyridine is CCCC1C(CC)=CC(CC)=CN1C.
What is the InChIKey of 3,5-diethyl-1-methyl-2-propyl-2H-pyridine?
The InChIKey is FGOVBBPABCSRIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N/c1-5-8-13-12(7-3)9-11(6-2)10-14(13)4/h9-10,13H,5-8H2,1-4H3.
What are the key properties of 3,5-diethyl-1-methyl-2-propyl-2H-pyridine?
3,5-diethyl-1-methyl-2-propyl-2H-pyridine has a molecular weight of 193.33 g/mol, XLogP of 3.73, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-diethyl-1-methyl-2-propyl-2H-pyridine is sourced from PubChem (CID 23344437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).