1-ethyl-4-(2-methyl-1H-imidazol-5-yl)piperidine

C11H19N3 — CID 90202035

IUPAC1-ethyl-4-(2-methyl-1H-imidazol-5-yl)piperidine
SMILESCCN1CCC(c2cnc(C)[nH]2)CC1
InChIInChI=1S/C11H19N3/c1-3-14-6-4-10(5-7-14)11-8-12-9(2)13-11/h8,10H,3-7H2,1-2H3,(H,12,13)
InChIKeyQYSGYABKCFAKRU-UHFFFAOYSA-N
MW193.29 g/mol
LogP1.92
Rot. Bonds2

About 1-ethyl-4-(2-methyl-1H-imidazol-5-yl)piperidine

1-ethyl-4-(2-methyl-1H-imidazol-5-yl)piperidine (PubChem CID 90202035) has the molecular formula C11H19N3 and a molecular weight of 193.29 g/mol. Its IUPAC name is 1-ethyl-4-(2-methyl-1H-imidazol-5-yl)piperidine.

Molecular Properties

Compound Name1-ethyl-4-(2-methyl-1H-imidazol-5-yl)piperidine
PubChem CID90202035
Molecular FormulaC11H19N3
Molecular Weight193.29 g/mol
Exact Mass193.16
IUPAC Name1-ethyl-4-(2-methyl-1H-imidazol-5-yl)piperidine
SMILESCCN1CCC(c2cnc(C)[nH]2)CC1
InChIInChI=1S/C11H19N3/c1-3-14-6-4-10(5-7-14)11-8-12-9(2)13-11/h8,10H,3-7H2,1-2H3,(H,12,13)
InChIKeyQYSGYABKCFAKRU-UHFFFAOYSA-N
XLogP1.92
TPSA31.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-ethyl-4-(2-methyl-1H-imidazol-5-yl)piperidine 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 1-ethyl-4-(2-methyl-1H-imidazol-5-yl)piperidine?
The IUPAC name of 1-ethyl-4-(2-methyl-1H-imidazol-5-yl)piperidine (CID 90202035) is 1-ethyl-4-(2-methyl-1H-imidazol-5-yl)piperidine.
What is the SMILES notation for 1-ethyl-4-(2-methyl-1H-imidazol-5-yl)piperidine?
The canonical SMILES for 1-ethyl-4-(2-methyl-1H-imidazol-5-yl)piperidine is CCN1CCC(c2cnc(C)[nH]2)CC1.
What is the InChIKey of 1-ethyl-4-(2-methyl-1H-imidazol-5-yl)piperidine?
The InChIKey is QYSGYABKCFAKRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3/c1-3-14-6-4-10(5-7-14)11-8-12-9(2)13-11/h8,10H,3-7H2,1-2H3,(H,12,13).
What are the key properties of 1-ethyl-4-(2-methyl-1H-imidazol-5-yl)piperidine?
1-ethyl-4-(2-methyl-1H-imidazol-5-yl)piperidine has a molecular weight of 193.29 g/mol, XLogP of 1.92, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-4-(2-methyl-1H-imidazol-5-yl)piperidine is sourced from PubChem (CID 90202035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).