4-methyl-1-[2-(2-propan-2-ylimidazol-1-yl)ethyl]piperidine

C14H25N3 — CID 75451217

IUPAC4-methyl-1-[2-(2-propan-2-ylimidazol-1-yl)ethyl]piperidine
SMILESCC1CCN(CCn2ccnc2C(C)C)CC1
InChIInChI=1S/C14H25N3/c1-12(2)14-15-6-9-17(14)11-10-16-7-4-13(3)5-8-16/h6,9,12-13H,4-5,7-8,10-11H2,1-3H3
InChIKeyLGLPPCFNWCZXFT-UHFFFAOYSA-N
MW235.38 g/mol
LogP2.74
Rot. Bonds4

About 4-methyl-1-[2-(2-propan-2-ylimidazol-1-yl)ethyl]piperidine

4-methyl-1-[2-(2-propan-2-ylimidazol-1-yl)ethyl]piperidine (PubChem CID 75451217) has the molecular formula C14H25N3 and a molecular weight of 235.38 g/mol. Its IUPAC name is 4-methyl-1-[2-(2-propan-2-ylimidazol-1-yl)ethyl]piperidine.

Molecular Properties

Compound Name4-methyl-1-[2-(2-propan-2-ylimidazol-1-yl)ethyl]piperidine
PubChem CID75451217
Molecular FormulaC14H25N3
Molecular Weight235.38 g/mol
Exact Mass235.20
IUPAC Name4-methyl-1-[2-(2-propan-2-ylimidazol-1-yl)ethyl]piperidine
SMILESCC1CCN(CCn2ccnc2C(C)C)CC1
InChIInChI=1S/C14H25N3/c1-12(2)14-15-6-9-17(14)11-10-16-7-4-13(3)5-8-16/h6,9,12-13H,4-5,7-8,10-11H2,1-3H3
InChIKeyLGLPPCFNWCZXFT-UHFFFAOYSA-N
XLogP2.74
TPSA21.06 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.38
LogP ≤ 52.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-Pentyl-1H-imidazole
CID 529334
1-Dodecylimidazole
CID 78002
1-Hexyl-3-methylimidazolium chloride
CID 2734163
1-Butyl-2,3-dimethylimidazolium chloride
CID 2734167
1-Hexyl-3-methylimidazolium Iodide
CID 12036651
1-nonyl-1H-imidazole
CID 193906
1H-Imidazole, 1-hexyl-
CID 3015660
1-Hexyl-3-methylimidazolium bromide
CID 2734237
1,2-Dimethyl-3-propylimidazolium Iodide
CID 11459786
1-Butyl-2-methyl-1H-imidazole
CID 304622
1-Butyl-3-methylimidazolium
CID 2734162
1-Butyl-2,3-dimethylimidazolium bromide
CID 2734241

Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-[2-(2-propan-2-ylimidazol-1-yl)ethyl]piperidine?
The IUPAC name of 4-methyl-1-[2-(2-propan-2-ylimidazol-1-yl)ethyl]piperidine (CID 75451217) is 4-methyl-1-[2-(2-propan-2-ylimidazol-1-yl)ethyl]piperidine.
What is the SMILES notation for 4-methyl-1-[2-(2-propan-2-ylimidazol-1-yl)ethyl]piperidine?
The canonical SMILES for 4-methyl-1-[2-(2-propan-2-ylimidazol-1-yl)ethyl]piperidine is CC1CCN(CCn2ccnc2C(C)C)CC1.
What is the InChIKey of 4-methyl-1-[2-(2-propan-2-ylimidazol-1-yl)ethyl]piperidine?
The InChIKey is LGLPPCFNWCZXFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3/c1-12(2)14-15-6-9-17(14)11-10-16-7-4-13(3)5-8-16/h6,9,12-13H,4-5,7-8,10-11H2,1-3H3.
What are the key properties of 4-methyl-1-[2-(2-propan-2-ylimidazol-1-yl)ethyl]piperidine?
4-methyl-1-[2-(2-propan-2-ylimidazol-1-yl)ethyl]piperidine has a molecular weight of 235.38 g/mol, XLogP of 2.74, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-[2-(2-propan-2-ylimidazol-1-yl)ethyl]piperidine is sourced from PubChem (CID 75451217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).