4-[2-(3-ethyl-2H-imidazol-1-yl)propan-2-yl]pyridine

C13H19N3 — CID 58107075

IUPAC4-[2-(3-ethyl-2H-imidazol-1-yl)propan-2-yl]pyridine
SMILESCCN1C=CN(C(C)(C)c2ccncc2)C1
InChIInChI=1S/C13H19N3/c1-4-15-9-10-16(11-15)13(2,3)12-5-7-14-8-6-12/h5-10H,4,11H2,1-3H3
InChIKeyJXFHUYFAAGTOCX-UHFFFAOYSA-N
MW217.32 g/mol
LogP2.38
Rot. Bonds3

About 4-[2-(3-ethyl-2H-imidazol-1-yl)propan-2-yl]pyridine

4-[2-(3-ethyl-2H-imidazol-1-yl)propan-2-yl]pyridine (PubChem CID 58107075) has the molecular formula C13H19N3 and a molecular weight of 217.32 g/mol. Its IUPAC name is 4-[2-(3-ethyl-2H-imidazol-1-yl)propan-2-yl]pyridine.

Molecular Properties

Compound Name4-[2-(3-ethyl-2H-imidazol-1-yl)propan-2-yl]pyridine
PubChem CID58107075
Molecular FormulaC13H19N3
Molecular Weight217.32 g/mol
Exact Mass217.16
IUPAC Name4-[2-(3-ethyl-2H-imidazol-1-yl)propan-2-yl]pyridine
SMILESCCN1C=CN(C(C)(C)c2ccncc2)C1
InChIInChI=1S/C13H19N3/c1-4-15-9-10-16(11-15)13(2,3)12-5-7-14-8-6-12/h5-10H,4,11H2,1-3H3
InChIKeyJXFHUYFAAGTOCX-UHFFFAOYSA-N
XLogP2.38
TPSA19.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.32
LogP ≤ 52.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 4-[2-(3-ethyl-2H-imidazol-1-yl)propan-2-yl]pyridine with MolForge

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

Launch Full Analysis

Related Compounds

Nicotine
CID 89594
Paraquat dichloride
CID 15938
3-Methylpyridine
CID 7970
3-(1-Methylpyrrolidin-2-yl)pyridine
CID 942
4-Methylpyridine
CID 7963
4-Vinylpyridine
CID 7502
Paraquat
CID 15939
Myosmine
CID 442649
5-Ethyl-2-methylpyridine
CID 7728
Anabaseine
CID 18985
Rivanicline
CID 5310967
4-Phenylpyridine
CID 13651

Frequently Asked Questions

What is the IUPAC name of 4-[2-(3-ethyl-2H-imidazol-1-yl)propan-2-yl]pyridine?
The IUPAC name of 4-[2-(3-ethyl-2H-imidazol-1-yl)propan-2-yl]pyridine (CID 58107075) is 4-[2-(3-ethyl-2H-imidazol-1-yl)propan-2-yl]pyridine.
What is the SMILES notation for 4-[2-(3-ethyl-2H-imidazol-1-yl)propan-2-yl]pyridine?
The canonical SMILES for 4-[2-(3-ethyl-2H-imidazol-1-yl)propan-2-yl]pyridine is CCN1C=CN(C(C)(C)c2ccncc2)C1.
What is the InChIKey of 4-[2-(3-ethyl-2H-imidazol-1-yl)propan-2-yl]pyridine?
The InChIKey is JXFHUYFAAGTOCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3/c1-4-15-9-10-16(11-15)13(2,3)12-5-7-14-8-6-12/h5-10H,4,11H2,1-3H3.
What are the key properties of 4-[2-(3-ethyl-2H-imidazol-1-yl)propan-2-yl]pyridine?
4-[2-(3-ethyl-2H-imidazol-1-yl)propan-2-yl]pyridine has a molecular weight of 217.32 g/mol, XLogP of 2.38, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(3-ethyl-2H-imidazol-1-yl)propan-2-yl]pyridine is sourced from PubChem (CID 58107075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).