2,2-diethyl-6,6-dimethyl-1-prop-2-enylpiperidin-4-amine

C14H28N2 — CID 20501057

IUPAC2,2-diethyl-6,6-dimethyl-1-prop-2-enylpiperidin-4-amine
SMILESC=CCN1C(C)(C)CC(N)CC1(CC)CC
InChIInChI=1S/C14H28N2/c1-6-9-16-13(4,5)10-12(15)11-14(16,7-2)8-3/h6,12H,1,7-11,15H2,2-5H3
InChIKeyIQWDCVGNBOORFL-UHFFFAOYSA-N
MW224.39 g/mol
LogP2.93
Rot. Bonds4

About 2,2-diethyl-6,6-dimethyl-1-prop-2-enylpiperidin-4-amine

2,2-diethyl-6,6-dimethyl-1-prop-2-enylpiperidin-4-amine (PubChem CID 20501057) has the molecular formula C14H28N2 and a molecular weight of 224.39 g/mol. Its IUPAC name is 2,2-diethyl-6,6-dimethyl-1-prop-2-enylpiperidin-4-amine.

Molecular Properties

Compound Name2,2-diethyl-6,6-dimethyl-1-prop-2-enylpiperidin-4-amine
PubChem CID20501057
Molecular FormulaC14H28N2
Molecular Weight224.39 g/mol
Exact Mass224.23
IUPAC Name2,2-diethyl-6,6-dimethyl-1-prop-2-enylpiperidin-4-amine
SMILESC=CCN1C(C)(C)CC(N)CC1(CC)CC
InChIInChI=1S/C14H28N2/c1-6-9-16-13(4,5)10-12(15)11-14(16,7-2)8-3/h6,12H,1,7-11,15H2,2-5H3
InChIKeyIQWDCVGNBOORFL-UHFFFAOYSA-N
XLogP2.93
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.39
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 2,2-diethyl-6,6-dimethyl-1-prop-2-enylpiperidin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2,2-diethyl-6,6-dimethyl-1-prop-2-enylpiperidin-4-amine?
The IUPAC name of 2,2-diethyl-6,6-dimethyl-1-prop-2-enylpiperidin-4-amine (CID 20501057) is 2,2-diethyl-6,6-dimethyl-1-prop-2-enylpiperidin-4-amine.
What is the SMILES notation for 2,2-diethyl-6,6-dimethyl-1-prop-2-enylpiperidin-4-amine?
The canonical SMILES for 2,2-diethyl-6,6-dimethyl-1-prop-2-enylpiperidin-4-amine is C=CCN1C(C)(C)CC(N)CC1(CC)CC.
What is the InChIKey of 2,2-diethyl-6,6-dimethyl-1-prop-2-enylpiperidin-4-amine?
The InChIKey is IQWDCVGNBOORFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2/c1-6-9-16-13(4,5)10-12(15)11-14(16,7-2)8-3/h6,12H,1,7-11,15H2,2-5H3.
What are the key properties of 2,2-diethyl-6,6-dimethyl-1-prop-2-enylpiperidin-4-amine?
2,2-diethyl-6,6-dimethyl-1-prop-2-enylpiperidin-4-amine has a molecular weight of 224.39 g/mol, XLogP of 2.93, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-diethyl-6,6-dimethyl-1-prop-2-enylpiperidin-4-amine is sourced from PubChem (CID 20501057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).