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

C11H19N3 — CID 173025527

IUPAC2-(2-ethyl-5-methyl-1H-imidazol-4-yl)piperidine
SMILESCCc1nc(C2CCCCN2)c(C)[nH]1
InChIInChI=1S/C11H19N3/c1-3-10-13-8(2)11(14-10)9-6-4-5-7-12-9/h9,12H,3-7H2,1-2H3,(H,13,14)
InChIKeyFEVHGDXRRDQXAF-UHFFFAOYSA-N
MW193.29 g/mol
LogP2.10
Rot. Bonds2

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

2-(2-ethyl-5-methyl-1H-imidazol-4-yl)piperidine (PubChem CID 173025527) has the molecular formula C11H19N3 and a molecular weight of 193.29 g/mol. Its IUPAC name is 2-(2-ethyl-5-methyl-1H-imidazol-4-yl)piperidine.

Molecular Properties

Compound Name2-(2-ethyl-5-methyl-1H-imidazol-4-yl)piperidine
PubChem CID173025527
Molecular FormulaC11H19N3
Molecular Weight193.29 g/mol
Exact Mass193.16
IUPAC Name2-(2-ethyl-5-methyl-1H-imidazol-4-yl)piperidine
SMILESCCc1nc(C2CCCCN2)c(C)[nH]1
InChIInChI=1S/C11H19N3/c1-3-10-13-8(2)11(14-10)9-6-4-5-7-12-9/h9,12H,3-7H2,1-2H3,(H,13,14)
InChIKeyFEVHGDXRRDQXAF-UHFFFAOYSA-N
XLogP2.10
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 52.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2-ethyl-5-methyl-1H-imidazol-4-yl)piperidine?
The IUPAC name of 2-(2-ethyl-5-methyl-1H-imidazol-4-yl)piperidine (CID 173025527) is 2-(2-ethyl-5-methyl-1H-imidazol-4-yl)piperidine.
What is the SMILES notation for 2-(2-ethyl-5-methyl-1H-imidazol-4-yl)piperidine?
The canonical SMILES for 2-(2-ethyl-5-methyl-1H-imidazol-4-yl)piperidine is CCc1nc(C2CCCCN2)c(C)[nH]1.
What is the InChIKey of 2-(2-ethyl-5-methyl-1H-imidazol-4-yl)piperidine?
The InChIKey is FEVHGDXRRDQXAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3/c1-3-10-13-8(2)11(14-10)9-6-4-5-7-12-9/h9,12H,3-7H2,1-2H3,(H,13,14).
What are the key properties of 2-(2-ethyl-5-methyl-1H-imidazol-4-yl)piperidine?
2-(2-ethyl-5-methyl-1H-imidazol-4-yl)piperidine has a molecular weight of 193.29 g/mol, XLogP of 2.10, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethyl-5-methyl-1H-imidazol-4-yl)piperidine is sourced from PubChem (CID 173025527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).