2-propan-2-yl-1-prop-1-en-2-ylpiperidine

C11H21N — CID 89390124

IUPAC2-propan-2-yl-1-prop-1-en-2-ylpiperidine
SMILESC=C(C)N1CCCCC1C(C)C
InChIInChI=1S/C11H21N/c1-9(2)11-7-5-6-8-12(11)10(3)4/h9,11H,3,5-8H2,1-2,4H3
InChIKeyRVCJVZVMJKPJLT-UHFFFAOYSA-N
MW167.30 g/mol
LogP3.03
Rot. Bonds2

About 2-propan-2-yl-1-prop-1-en-2-ylpiperidine

2-propan-2-yl-1-prop-1-en-2-ylpiperidine (PubChem CID 89390124) has the molecular formula C11H21N and a molecular weight of 167.30 g/mol. Its IUPAC name is 2-propan-2-yl-1-prop-1-en-2-ylpiperidine.

Molecular Properties

Compound Name2-propan-2-yl-1-prop-1-en-2-ylpiperidine
PubChem CID89390124
Molecular FormulaC11H21N
Molecular Weight167.30 g/mol
Exact Mass167.17
IUPAC Name2-propan-2-yl-1-prop-1-en-2-ylpiperidine
SMILESC=C(C)N1CCCCC1C(C)C
InChIInChI=1S/C11H21N/c1-9(2)11-7-5-6-8-12(11)10(3)4/h9,11H,3,5-8H2,1-2,4H3
InChIKeyRVCJVZVMJKPJLT-UHFFFAOYSA-N
XLogP3.03
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.30
LogP ≤ 53.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-propan-2-yl-1-prop-1-en-2-ylpiperidine?
The IUPAC name of 2-propan-2-yl-1-prop-1-en-2-ylpiperidine (CID 89390124) is 2-propan-2-yl-1-prop-1-en-2-ylpiperidine.
What is the SMILES notation for 2-propan-2-yl-1-prop-1-en-2-ylpiperidine?
The canonical SMILES for 2-propan-2-yl-1-prop-1-en-2-ylpiperidine is C=C(C)N1CCCCC1C(C)C.
What is the InChIKey of 2-propan-2-yl-1-prop-1-en-2-ylpiperidine?
The InChIKey is RVCJVZVMJKPJLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N/c1-9(2)11-7-5-6-8-12(11)10(3)4/h9,11H,3,5-8H2,1-2,4H3.
What are the key properties of 2-propan-2-yl-1-prop-1-en-2-ylpiperidine?
2-propan-2-yl-1-prop-1-en-2-ylpiperidine has a molecular weight of 167.30 g/mol, XLogP of 3.03, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propan-2-yl-1-prop-1-en-2-ylpiperidine is sourced from PubChem (CID 89390124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).