2,6-diethyl-2,3,6-trimethyl-1-prop-2-enylpiperidine

C15H29N — CID 22754588

IUPAC2,6-diethyl-2,3,6-trimethyl-1-prop-2-enylpiperidine
SMILESC=CCN1C(C)(CC)CCC(C)C1(C)CC
InChIInChI=1S/C15H29N/c1-7-12-16-14(5,8-2)11-10-13(4)15(16,6)9-3/h7,13H,1,8-12H2,2-6H3
InChIKeyIADHPFZMSTVIBT-UHFFFAOYSA-N
MW223.40 g/mol
LogP4.24
Rot. Bonds4

About 2,6-diethyl-2,3,6-trimethyl-1-prop-2-enylpiperidine

2,6-diethyl-2,3,6-trimethyl-1-prop-2-enylpiperidine (PubChem CID 22754588) has the molecular formula C15H29N and a molecular weight of 223.40 g/mol. Its IUPAC name is 2,6-diethyl-2,3,6-trimethyl-1-prop-2-enylpiperidine.

Molecular Properties

Compound Name2,6-diethyl-2,3,6-trimethyl-1-prop-2-enylpiperidine
PubChem CID22754588
Molecular FormulaC15H29N
Molecular Weight223.40 g/mol
Exact Mass223.23
IUPAC Name2,6-diethyl-2,3,6-trimethyl-1-prop-2-enylpiperidine
SMILESC=CCN1C(C)(CC)CCC(C)C1(C)CC
InChIInChI=1S/C15H29N/c1-7-12-16-14(5,8-2)11-10-13(4)15(16,6)9-3/h7,13H,1,8-12H2,2-6H3
InChIKeyIADHPFZMSTVIBT-UHFFFAOYSA-N
XLogP4.24
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.40
LogP ≤ 54.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

Piproctanyl bromide
CID 3034411
Piproctanyl
CID 92514
2,2,6,6-Tetramethyl-1-prop-2-enylpiperidine
CID 19606683
2,6-Diethyl-2,3,6-trimethyl-1-prop-2-enylpiperidin-4-amine
CID 20270968
4-Ethenyl-1,2,2,6,6-pentamethylpiperidine
CID 20501061
4-Propan-2-yl-1-prop-2-enylpiperidine
CID 20811791
2,2,4,6,6-Pentamethyl-1-prop-2-enylpiperidine
CID 21292142
1-[(E)-but-2-enyl]-2,2,6,6-tetramethylpiperidine
CID 21517320
3-Ethyl-2,6-dimethyl-1-prop-2-enyl-2,6-dipropylpiperidine
CID 22754561
1,2,2,3-Tetramethyl-1-undec-10-enylpiperidin-1-ium
CID 53690062
1-But-2-enyl-2,2,6,6-tetramethylpiperidine
CID 53934221
1,2,2,6,6-Pentamethyl-4-prop-2-enylpiperidine
CID 54088668

Frequently Asked Questions

What is the IUPAC name of 2,6-diethyl-2,3,6-trimethyl-1-prop-2-enylpiperidine?
The IUPAC name of 2,6-diethyl-2,3,6-trimethyl-1-prop-2-enylpiperidine (CID 22754588) is 2,6-diethyl-2,3,6-trimethyl-1-prop-2-enylpiperidine.
What is the SMILES notation for 2,6-diethyl-2,3,6-trimethyl-1-prop-2-enylpiperidine?
The canonical SMILES for 2,6-diethyl-2,3,6-trimethyl-1-prop-2-enylpiperidine is C=CCN1C(C)(CC)CCC(C)C1(C)CC.
What is the InChIKey of 2,6-diethyl-2,3,6-trimethyl-1-prop-2-enylpiperidine?
The InChIKey is IADHPFZMSTVIBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N/c1-7-12-16-14(5,8-2)11-10-13(4)15(16,6)9-3/h7,13H,1,8-12H2,2-6H3.
What are the key properties of 2,6-diethyl-2,3,6-trimethyl-1-prop-2-enylpiperidine?
2,6-diethyl-2,3,6-trimethyl-1-prop-2-enylpiperidine has a molecular weight of 223.40 g/mol, XLogP of 4.24, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-diethyl-2,3,6-trimethyl-1-prop-2-enylpiperidine is sourced from PubChem (CID 22754588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).