4-[2-(2,5-dimethylimidazol-1-yl)ethyl]piperidine

C12H21N3 — CID 172909232

IUPAC4-[2-(2,5-dimethylimidazol-1-yl)ethyl]piperidine
SMILESCc1cnc(C)n1CCC1CCNCC1
InChIInChI=1S/C12H21N3/c1-10-9-14-11(2)15(10)8-5-12-3-6-13-7-4-12/h9,12-13H,3-8H2,1-2H3
InChIKeyMZQTZLQGXIRTTL-UHFFFAOYSA-N
MW207.32 g/mol
LogP1.89
Rot. Bonds3

About 4-[2-(2,5-dimethylimidazol-1-yl)ethyl]piperidine

4-[2-(2,5-dimethylimidazol-1-yl)ethyl]piperidine (PubChem CID 172909232) has the molecular formula C12H21N3 and a molecular weight of 207.32 g/mol. Its IUPAC name is 4-[2-(2,5-dimethylimidazol-1-yl)ethyl]piperidine.

Molecular Properties

Compound Name4-[2-(2,5-dimethylimidazol-1-yl)ethyl]piperidine
PubChem CID172909232
Molecular FormulaC12H21N3
Molecular Weight207.32 g/mol
Exact Mass207.17
IUPAC Name4-[2-(2,5-dimethylimidazol-1-yl)ethyl]piperidine
SMILESCc1cnc(C)n1CCC1CCNCC1
InChIInChI=1S/C12H21N3/c1-10-9-14-11(2)15(10)8-5-12-3-6-13-7-4-12/h9,12-13H,3-8H2,1-2H3
InChIKeyMZQTZLQGXIRTTL-UHFFFAOYSA-N
XLogP1.89
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.32
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-[2-(2,4,5-trimethylimidazol-1-yl)ethyl]piperidine
CID 82512786
4-[1-(cyclopropylmethyl)-5-methylimidazol-2-yl]piperidine
CID 176515434
5-bromo-3-(2-cyclopropylethyl)-2-methylpyrimidin-4-one
CID 66310504
5-methyl-N-(2-piperidin-4-ylethyl)pyrimidin-2-amine
CID 116975989
4-[(1-benzyl-5-methylimidazol-2-yl)methyl]piperidine
CID 176515378
3-[2-(azetidin-3-yl)ethyl]-5-iodo-2-methylpyrimidin-4-one
CID 107391335
4-[2-(4-tert-butylimidazol-1-yl)ethyl]piperidine
CID 82513262
4-[3-(4-methylimidazol-1-yl)propyl]piperidine
CID 22662903
4-[2-(5-methyl-1H-imidazol-2-yl)ethyl]piperidine
CID 67753697
3-[5-methyl-1-(piperidin-4-ylmethyl)imidazol-2-yl]pyridine;dihydrochloride
CID 146064750
N-[[3-(2-cyclopentylethyl)-2-methylimidazol-4-yl]methyl]ethanamine
CID 114192847
1-methyl-N-(2-piperidin-4-ylethyl)pyrazol-4-amine
CID 103568741

Frequently Asked Questions

What is the IUPAC name of 4-[2-(2,5-dimethylimidazol-1-yl)ethyl]piperidine?
The IUPAC name of 4-[2-(2,5-dimethylimidazol-1-yl)ethyl]piperidine (CID 172909232) is 4-[2-(2,5-dimethylimidazol-1-yl)ethyl]piperidine.
What is the SMILES notation for 4-[2-(2,5-dimethylimidazol-1-yl)ethyl]piperidine?
The canonical SMILES for 4-[2-(2,5-dimethylimidazol-1-yl)ethyl]piperidine is Cc1cnc(C)n1CCC1CCNCC1.
What is the InChIKey of 4-[2-(2,5-dimethylimidazol-1-yl)ethyl]piperidine?
The InChIKey is MZQTZLQGXIRTTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3/c1-10-9-14-11(2)15(10)8-5-12-3-6-13-7-4-12/h9,12-13H,3-8H2,1-2H3.
What are the key properties of 4-[2-(2,5-dimethylimidazol-1-yl)ethyl]piperidine?
4-[2-(2,5-dimethylimidazol-1-yl)ethyl]piperidine has a molecular weight of 207.32 g/mol, XLogP of 1.89, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(2,5-dimethylimidazol-1-yl)ethyl]piperidine is sourced from PubChem (CID 172909232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).