3-(2-propan-2-yl-1H-imidazol-5-yl)piperidine

C11H19N3 — CID 82656850

IUPAC3-(2-propan-2-yl-1H-imidazol-5-yl)piperidine
SMILESCC(C)c1ncc(C2CCCNC2)[nH]1
InChIInChI=1S/C11H19N3/c1-8(2)11-13-7-10(14-11)9-4-3-5-12-6-9/h7-9,12H,3-6H2,1-2H3,(H,13,14)
InChIKeyNFCZSUZAAWNSPZ-UHFFFAOYSA-N
MW193.29 g/mol
LogP2.00
Rot. Bonds2

About 3-(2-propan-2-yl-1H-imidazol-5-yl)piperidine

3-(2-propan-2-yl-1H-imidazol-5-yl)piperidine (PubChem CID 82656850) has the molecular formula C11H19N3 and a molecular weight of 193.29 g/mol. Its IUPAC name is 3-(2-propan-2-yl-1H-imidazol-5-yl)piperidine.

Molecular Properties

Compound Name3-(2-propan-2-yl-1H-imidazol-5-yl)piperidine
PubChem CID82656850
Molecular FormulaC11H19N3
Molecular Weight193.29 g/mol
Exact Mass193.16
IUPAC Name3-(2-propan-2-yl-1H-imidazol-5-yl)piperidine
SMILESCC(C)c1ncc(C2CCCNC2)[nH]1
InChIInChI=1S/C11H19N3/c1-8(2)11-13-7-10(14-11)9-4-3-5-12-6-9/h7-9,12H,3-6H2,1-2H3,(H,13,14)
InChIKeyNFCZSUZAAWNSPZ-UHFFFAOYSA-N
XLogP2.00
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 ≤ 52.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(2-propan-2-yl-1H-imidazol-5-yl)piperidine?
The IUPAC name of 3-(2-propan-2-yl-1H-imidazol-5-yl)piperidine (CID 82656850) is 3-(2-propan-2-yl-1H-imidazol-5-yl)piperidine.
What is the SMILES notation for 3-(2-propan-2-yl-1H-imidazol-5-yl)piperidine?
The canonical SMILES for 3-(2-propan-2-yl-1H-imidazol-5-yl)piperidine is CC(C)c1ncc(C2CCCNC2)[nH]1.
What is the InChIKey of 3-(2-propan-2-yl-1H-imidazol-5-yl)piperidine?
The InChIKey is NFCZSUZAAWNSPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3/c1-8(2)11-13-7-10(14-11)9-4-3-5-12-6-9/h7-9,12H,3-6H2,1-2H3,(H,13,14).
What are the key properties of 3-(2-propan-2-yl-1H-imidazol-5-yl)piperidine?
3-(2-propan-2-yl-1H-imidazol-5-yl)piperidine has a molecular weight of 193.29 g/mol, XLogP of 2.00, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-propan-2-yl-1H-imidazol-5-yl)piperidine is sourced from PubChem (CID 82656850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).