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

C11H19N3 — CID 67753697

IUPAC4-[2-(5-methyl-1H-imidazol-2-yl)ethyl]piperidine
SMILESCc1cnc(CCC2CCNCC2)[nH]1
InChIInChI=1S/C11H19N3/c1-9-8-13-11(14-9)3-2-10-4-6-12-7-5-10/h8,10,12H,2-7H2,1H3,(H,13,14)
InChIKeyQELYAJGCWLZUDF-UHFFFAOYSA-N
MW193.29 g/mol
LogP1.65
Rot. Bonds3

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

4-[2-(5-methyl-1H-imidazol-2-yl)ethyl]piperidine (PubChem CID 67753697) has the molecular formula C11H19N3 and a molecular weight of 193.29 g/mol. Its IUPAC name is 4-[2-(5-methyl-1H-imidazol-2-yl)ethyl]piperidine.

Molecular Properties

Compound Name4-[2-(5-methyl-1H-imidazol-2-yl)ethyl]piperidine
PubChem CID67753697
Molecular FormulaC11H19N3
Molecular Weight193.29 g/mol
Exact Mass193.16
IUPAC Name4-[2-(5-methyl-1H-imidazol-2-yl)ethyl]piperidine
SMILESCc1cnc(CCC2CCNCC2)[nH]1
InChIInChI=1S/C11H19N3/c1-9-8-13-11(14-9)3-2-10-4-6-12-7-5-10/h8,10,12H,2-7H2,1H3,(H,13,14)
InChIKeyQELYAJGCWLZUDF-UHFFFAOYSA-N
XLogP1.65
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 51.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-[2-(5-methyl-1H-imidazol-2-yl)ethyl]piperidine?
The IUPAC name of 4-[2-(5-methyl-1H-imidazol-2-yl)ethyl]piperidine (CID 67753697) is 4-[2-(5-methyl-1H-imidazol-2-yl)ethyl]piperidine.
What is the SMILES notation for 4-[2-(5-methyl-1H-imidazol-2-yl)ethyl]piperidine?
The canonical SMILES for 4-[2-(5-methyl-1H-imidazol-2-yl)ethyl]piperidine is Cc1cnc(CCC2CCNCC2)[nH]1.
What is the InChIKey of 4-[2-(5-methyl-1H-imidazol-2-yl)ethyl]piperidine?
The InChIKey is QELYAJGCWLZUDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3/c1-9-8-13-11(14-9)3-2-10-4-6-12-7-5-10/h8,10,12H,2-7H2,1H3,(H,13,14).
What are the key properties of 4-[2-(5-methyl-1H-imidazol-2-yl)ethyl]piperidine?
4-[2-(5-methyl-1H-imidazol-2-yl)ethyl]piperidine has a molecular weight of 193.29 g/mol, XLogP of 1.65, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(5-methyl-1H-imidazol-2-yl)ethyl]piperidine is sourced from PubChem (CID 67753697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).