4-[2-(1H-imidazol-5-yl)ethyl]-1-methylpiperidine

C11H19N3 — CID 11739735

IUPAC4-[2-(1H-imidazol-5-yl)ethyl]-1-methylpiperidine
SMILESCN1CCC(CCc2cnc[nH]2)CC1
InChIInChI=1S/C11H19N3/c1-14-6-4-10(5-7-14)2-3-11-8-12-9-13-11/h8-10H,2-7H2,1H3,(H,12,13)
InChIKeyHYCFLORUENSVSY-UHFFFAOYSA-N
MW193.29 g/mol
LogP1.68
Rot. Bonds3

About 4-[2-(1H-imidazol-5-yl)ethyl]-1-methylpiperidine

4-[2-(1H-imidazol-5-yl)ethyl]-1-methylpiperidine (PubChem CID 11739735) has the molecular formula C11H19N3 and a molecular weight of 193.29 g/mol. Its IUPAC name is 4-[2-(1H-imidazol-5-yl)ethyl]-1-methylpiperidine.

Molecular Properties

Compound Name4-[2-(1H-imidazol-5-yl)ethyl]-1-methylpiperidine
PubChem CID11739735
Molecular FormulaC11H19N3
Molecular Weight193.29 g/mol
Exact Mass193.16
IUPAC Name4-[2-(1H-imidazol-5-yl)ethyl]-1-methylpiperidine
SMILESCN1CCC(CCc2cnc[nH]2)CC1
InChIInChI=1S/C11H19N3/c1-14-6-4-10(5-7-14)2-3-11-8-12-9-13-11/h8-10H,2-7H2,1H3,(H,12,13)
InChIKeyHYCFLORUENSVSY-UHFFFAOYSA-N
XLogP1.68
TPSA31.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 4-[2-(1H-imidazol-5-yl)ethyl]-1-methylpiperidine 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-[2-(1H-imidazol-5-yl)ethyl]-1-methylpiperidine?
The IUPAC name of 4-[2-(1H-imidazol-5-yl)ethyl]-1-methylpiperidine (CID 11739735) is 4-[2-(1H-imidazol-5-yl)ethyl]-1-methylpiperidine.
What is the SMILES notation for 4-[2-(1H-imidazol-5-yl)ethyl]-1-methylpiperidine?
The canonical SMILES for 4-[2-(1H-imidazol-5-yl)ethyl]-1-methylpiperidine is CN1CCC(CCc2cnc[nH]2)CC1.
What is the InChIKey of 4-[2-(1H-imidazol-5-yl)ethyl]-1-methylpiperidine?
The InChIKey is HYCFLORUENSVSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3/c1-14-6-4-10(5-7-14)2-3-11-8-12-9-13-11/h8-10H,2-7H2,1H3,(H,12,13).
What are the key properties of 4-[2-(1H-imidazol-5-yl)ethyl]-1-methylpiperidine?
4-[2-(1H-imidazol-5-yl)ethyl]-1-methylpiperidine has a molecular weight of 193.29 g/mol, XLogP of 1.68, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(1H-imidazol-5-yl)ethyl]-1-methylpiperidine is sourced from PubChem (CID 11739735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).