3-(2,2,6,6-tetramethylpiperidin-3-yl)prop-1-en-1-amine

C12H24N2 — CID 70302406

IUPAC3-(2,2,6,6-tetramethylpiperidin-3-yl)prop-1-en-1-amine
SMILESCC1(C)CCC(CC=CN)C(C)(C)N1
InChIInChI=1S/C12H24N2/c1-11(2)8-7-10(6-5-9-13)12(3,4)14-11/h5,9-10,14H,6-8,13H2,1-4H3
InChIKeyJZBDZBPLRQPLQU-UHFFFAOYSA-N
MW196.34 g/mol
LogP2.41
Rot. Bonds2

About 3-(2,2,6,6-tetramethylpiperidin-3-yl)prop-1-en-1-amine

3-(2,2,6,6-tetramethylpiperidin-3-yl)prop-1-en-1-amine (PubChem CID 70302406) has the molecular formula C12H24N2 and a molecular weight of 196.34 g/mol. Its IUPAC name is 3-(2,2,6,6-tetramethylpiperidin-3-yl)prop-1-en-1-amine.

Molecular Properties

Compound Name3-(2,2,6,6-tetramethylpiperidin-3-yl)prop-1-en-1-amine
PubChem CID70302406
Molecular FormulaC12H24N2
Molecular Weight196.34 g/mol
Exact Mass196.19
IUPAC Name3-(2,2,6,6-tetramethylpiperidin-3-yl)prop-1-en-1-amine
SMILESCC1(C)CCC(CC=CN)C(C)(C)N1
InChIInChI=1S/C12H24N2/c1-11(2)8-7-10(6-5-9-13)12(3,4)14-11/h5,9-10,14H,6-8,13H2,1-4H3
InChIKeyJZBDZBPLRQPLQU-UHFFFAOYSA-N
XLogP2.41
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.34
LogP ≤ 52.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(2,2,6,6-tetramethylpiperidin-3-yl)prop-1-en-1-amine?
The IUPAC name of 3-(2,2,6,6-tetramethylpiperidin-3-yl)prop-1-en-1-amine (CID 70302406) is 3-(2,2,6,6-tetramethylpiperidin-3-yl)prop-1-en-1-amine.
What is the SMILES notation for 3-(2,2,6,6-tetramethylpiperidin-3-yl)prop-1-en-1-amine?
The canonical SMILES for 3-(2,2,6,6-tetramethylpiperidin-3-yl)prop-1-en-1-amine is CC1(C)CCC(CC=CN)C(C)(C)N1.
What is the InChIKey of 3-(2,2,6,6-tetramethylpiperidin-3-yl)prop-1-en-1-amine?
The InChIKey is JZBDZBPLRQPLQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2/c1-11(2)8-7-10(6-5-9-13)12(3,4)14-11/h5,9-10,14H,6-8,13H2,1-4H3.
What are the key properties of 3-(2,2,6,6-tetramethylpiperidin-3-yl)prop-1-en-1-amine?
3-(2,2,6,6-tetramethylpiperidin-3-yl)prop-1-en-1-amine has a molecular weight of 196.34 g/mol, XLogP of 2.41, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,2,6,6-tetramethylpiperidin-3-yl)prop-1-en-1-amine is sourced from PubChem (CID 70302406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).