3-(2-propan-2-ylimidazol-1-yl)piperidine

C11H19N3 — CID 54592640

IUPAC3-(2-propan-2-ylimidazol-1-yl)piperidine
SMILESCC(C)c1nccn1C1CCCNC1
InChIInChI=1S/C11H19N3/c1-9(2)11-13-6-7-14(11)10-4-3-5-12-8-10/h6-7,9-10,12H,3-5,8H2,1-2H3
InChIKeyFCKKINSVCUYPGP-UHFFFAOYSA-N
MW193.29 g/mol
LogP1.93
Rot. Bonds2

About 3-(2-propan-2-ylimidazol-1-yl)piperidine

3-(2-propan-2-ylimidazol-1-yl)piperidine (PubChem CID 54592640) has the molecular formula C11H19N3 and a molecular weight of 193.29 g/mol. Its IUPAC name is 3-(2-propan-2-ylimidazol-1-yl)piperidine.

Molecular Properties

Compound Name3-(2-propan-2-ylimidazol-1-yl)piperidine
PubChem CID54592640
Molecular FormulaC11H19N3
Molecular Weight193.29 g/mol
Exact Mass193.16
IUPAC Name3-(2-propan-2-ylimidazol-1-yl)piperidine
SMILESCC(C)c1nccn1C1CCCNC1
InChIInChI=1S/C11H19N3/c1-9(2)11-13-6-7-14(11)10-4-3-5-12-8-10/h6-7,9-10,12H,3-5,8H2,1-2H3
InChIKeyFCKKINSVCUYPGP-UHFFFAOYSA-N
XLogP1.93
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 ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(2-propan-2-ylimidazol-1-yl)piperidine?
The IUPAC name of 3-(2-propan-2-ylimidazol-1-yl)piperidine (CID 54592640) is 3-(2-propan-2-ylimidazol-1-yl)piperidine.
What is the SMILES notation for 3-(2-propan-2-ylimidazol-1-yl)piperidine?
The canonical SMILES for 3-(2-propan-2-ylimidazol-1-yl)piperidine is CC(C)c1nccn1C1CCCNC1.
What is the InChIKey of 3-(2-propan-2-ylimidazol-1-yl)piperidine?
The InChIKey is FCKKINSVCUYPGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3/c1-9(2)11-13-6-7-14(11)10-4-3-5-12-8-10/h6-7,9-10,12H,3-5,8H2,1-2H3.
What are the key properties of 3-(2-propan-2-ylimidazol-1-yl)piperidine?
3-(2-propan-2-ylimidazol-1-yl)piperidine has a molecular weight of 193.29 g/mol, XLogP of 1.93, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-propan-2-ylimidazol-1-yl)piperidine is sourced from PubChem (CID 54592640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).