4-(1-ethyl-4-methylimidazol-2-yl)piperidine

C11H19N3 — CID 82463366

IUPAC4-(1-ethyl-4-methylimidazol-2-yl)piperidine
SMILESCCn1cc(C)nc1C1CCNCC1
InChIInChI=1S/C11H19N3/c1-3-14-8-9(2)13-11(14)10-4-6-12-7-5-10/h8,10,12H,3-7H2,1-2H3
InChIKeyFRRSCBKJLHEBLR-UHFFFAOYSA-N
MW193.29 g/mol
LogP1.68
Rot. Bonds2

About 4-(1-ethyl-4-methylimidazol-2-yl)piperidine

4-(1-ethyl-4-methylimidazol-2-yl)piperidine (PubChem CID 82463366) has the molecular formula C11H19N3 and a molecular weight of 193.29 g/mol. Its IUPAC name is 4-(1-ethyl-4-methylimidazol-2-yl)piperidine.

Molecular Properties

Compound Name4-(1-ethyl-4-methylimidazol-2-yl)piperidine
PubChem CID82463366
Molecular FormulaC11H19N3
Molecular Weight193.29 g/mol
Exact Mass193.16
IUPAC Name4-(1-ethyl-4-methylimidazol-2-yl)piperidine
SMILESCCn1cc(C)nc1C1CCNCC1
InChIInChI=1S/C11H19N3/c1-3-14-8-9(2)13-11(14)10-4-6-12-7-5-10/h8,10,12H,3-7H2,1-2H3
InChIKeyFRRSCBKJLHEBLR-UHFFFAOYSA-N
XLogP1.68
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
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 ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(1-ethyl-4-methylimidazol-2-yl)piperidine?
The IUPAC name of 4-(1-ethyl-4-methylimidazol-2-yl)piperidine (CID 82463366) is 4-(1-ethyl-4-methylimidazol-2-yl)piperidine.
What is the SMILES notation for 4-(1-ethyl-4-methylimidazol-2-yl)piperidine?
The canonical SMILES for 4-(1-ethyl-4-methylimidazol-2-yl)piperidine is CCn1cc(C)nc1C1CCNCC1.
What is the InChIKey of 4-(1-ethyl-4-methylimidazol-2-yl)piperidine?
The InChIKey is FRRSCBKJLHEBLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3/c1-3-14-8-9(2)13-11(14)10-4-6-12-7-5-10/h8,10,12H,3-7H2,1-2H3.
What are the key properties of 4-(1-ethyl-4-methylimidazol-2-yl)piperidine?
4-(1-ethyl-4-methylimidazol-2-yl)piperidine has a molecular weight of 193.29 g/mol, XLogP of 1.68, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-ethyl-4-methylimidazol-2-yl)piperidine is sourced from PubChem (CID 82463366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).