3,3-dimethyl-2-prop-2-enylpiperidine

C10H19N — CID 86811575

IUPAC3,3-dimethyl-2-prop-2-enylpiperidine
SMILESC=CCC1NCCCC1(C)C
InChIInChI=1S/C10H19N/c1-4-6-9-10(2,3)7-5-8-11-9/h4,9,11H,1,5-8H2,2-3H3
InChIKeyVWYNTDQUJQCEMX-UHFFFAOYSA-N
MW153.27 g/mol
LogP2.34
Rot. Bonds2

About 3,3-dimethyl-2-prop-2-enylpiperidine

3,3-dimethyl-2-prop-2-enylpiperidine (PubChem CID 86811575) has the molecular formula C10H19N and a molecular weight of 153.27 g/mol. Its IUPAC name is 3,3-dimethyl-2-prop-2-enylpiperidine.

Molecular Properties

Compound Name3,3-dimethyl-2-prop-2-enylpiperidine
PubChem CID86811575
Molecular FormulaC10H19N
Molecular Weight153.27 g/mol
Exact Mass153.15
IUPAC Name3,3-dimethyl-2-prop-2-enylpiperidine
SMILESC=CCC1NCCCC1(C)C
InChIInChI=1S/C10H19N/c1-4-6-9-10(2,3)7-5-8-11-9/h4,9,11H,1,5-8H2,2-3H3
InChIKeyVWYNTDQUJQCEMX-UHFFFAOYSA-N
XLogP2.34
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.27
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3,3-dimethyl-2-prop-2-enylpiperidine?
The IUPAC name of 3,3-dimethyl-2-prop-2-enylpiperidine (CID 86811575) is 3,3-dimethyl-2-prop-2-enylpiperidine.
What is the SMILES notation for 3,3-dimethyl-2-prop-2-enylpiperidine?
The canonical SMILES for 3,3-dimethyl-2-prop-2-enylpiperidine is C=CCC1NCCCC1(C)C.
What is the InChIKey of 3,3-dimethyl-2-prop-2-enylpiperidine?
The InChIKey is VWYNTDQUJQCEMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N/c1-4-6-9-10(2,3)7-5-8-11-9/h4,9,11H,1,5-8H2,2-3H3.
What are the key properties of 3,3-dimethyl-2-prop-2-enylpiperidine?
3,3-dimethyl-2-prop-2-enylpiperidine has a molecular weight of 153.27 g/mol, XLogP of 2.34, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-dimethyl-2-prop-2-enylpiperidine is sourced from PubChem (CID 86811575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).