2,2-bis(prop-2-enyl)piperidin-3-amine

C11H20N2 — CID 68822087

IUPAC2,2-bis(prop-2-enyl)piperidin-3-amine
SMILESC=CCC1(CC=C)NCCCC1N
InChIInChI=1S/C11H20N2/c1-3-7-11(8-4-2)10(12)6-5-9-13-11/h3-4,10,13H,1-2,5-9,12H2
InChIKeyLUQXDURGPAECAC-UHFFFAOYSA-N
MW180.29 g/mol
LogP1.59
Rot. Bonds4

About 2,2-bis(prop-2-enyl)piperidin-3-amine

2,2-bis(prop-2-enyl)piperidin-3-amine (PubChem CID 68822087) has the molecular formula C11H20N2 and a molecular weight of 180.29 g/mol. Its IUPAC name is 2,2-bis(prop-2-enyl)piperidin-3-amine.

Molecular Properties

Compound Name2,2-bis(prop-2-enyl)piperidin-3-amine
PubChem CID68822087
Molecular FormulaC11H20N2
Molecular Weight180.29 g/mol
Exact Mass180.16
IUPAC Name2,2-bis(prop-2-enyl)piperidin-3-amine
SMILESC=CCC1(CC=C)NCCCC1N
InChIInChI=1S/C11H20N2/c1-3-7-11(8-4-2)10(12)6-5-9-13-11/h3-4,10,13H,1-2,5-9,12H2
InChIKeyLUQXDURGPAECAC-UHFFFAOYSA-N
XLogP1.59
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.29
LogP ≤ 51.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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 2,2-bis(prop-2-enyl)piperidin-3-amine?
The IUPAC name of 2,2-bis(prop-2-enyl)piperidin-3-amine (CID 68822087) is 2,2-bis(prop-2-enyl)piperidin-3-amine.
What is the SMILES notation for 2,2-bis(prop-2-enyl)piperidin-3-amine?
The canonical SMILES for 2,2-bis(prop-2-enyl)piperidin-3-amine is C=CCC1(CC=C)NCCCC1N.
What is the InChIKey of 2,2-bis(prop-2-enyl)piperidin-3-amine?
The InChIKey is LUQXDURGPAECAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2/c1-3-7-11(8-4-2)10(12)6-5-9-13-11/h3-4,10,13H,1-2,5-9,12H2.
What are the key properties of 2,2-bis(prop-2-enyl)piperidin-3-amine?
2,2-bis(prop-2-enyl)piperidin-3-amine has a molecular weight of 180.29 g/mol, XLogP of 1.59, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-bis(prop-2-enyl)piperidin-3-amine is sourced from PubChem (CID 68822087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).