N,2,2,6,6-pentamethyl-N-prop-2-enylpiperidin-4-amine

C13H26N2 — CID 18619904

IUPACN,2,2,6,6-pentamethyl-N-prop-2-enylpiperidin-4-amine
SMILESC=CCN(C)C1CC(C)(C)NC(C)(C)C1
InChIInChI=1S/C13H26N2/c1-7-8-15(6)11-9-12(2,3)14-13(4,5)10-11/h7,11,14H,1,8-10H2,2-6H3
InChIKeyHTOCUEIDXVYZAO-UHFFFAOYSA-N
MW210.36 g/mol
LogP2.41
Rot. Bonds3

About N,2,2,6,6-pentamethyl-N-prop-2-enylpiperidin-4-amine

N,2,2,6,6-pentamethyl-N-prop-2-enylpiperidin-4-amine (PubChem CID 18619904) has the molecular formula C13H26N2 and a molecular weight of 210.36 g/mol. Its IUPAC name is N,2,2,6,6-pentamethyl-N-prop-2-enylpiperidin-4-amine.

Molecular Properties

Compound NameN,2,2,6,6-pentamethyl-N-prop-2-enylpiperidin-4-amine
PubChem CID18619904
Molecular FormulaC13H26N2
Molecular Weight210.36 g/mol
Exact Mass210.21
IUPAC NameN,2,2,6,6-pentamethyl-N-prop-2-enylpiperidin-4-amine
SMILESC=CCN(C)C1CC(C)(C)NC(C)(C)C1
InChIInChI=1S/C13H26N2/c1-7-8-15(6)11-9-12(2,3)14-13(4,5)10-11/h7,11,14H,1,8-10H2,2-6H3
InChIKeyHTOCUEIDXVYZAO-UHFFFAOYSA-N
XLogP2.41
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.36
LogP ≤ 52.41
H-Bond Donors ≤ 51
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 N,2,2,6,6-pentamethyl-N-prop-2-enylpiperidin-4-amine?
The IUPAC name of N,2,2,6,6-pentamethyl-N-prop-2-enylpiperidin-4-amine (CID 18619904) is N,2,2,6,6-pentamethyl-N-prop-2-enylpiperidin-4-amine.
What is the SMILES notation for N,2,2,6,6-pentamethyl-N-prop-2-enylpiperidin-4-amine?
The canonical SMILES for N,2,2,6,6-pentamethyl-N-prop-2-enylpiperidin-4-amine is C=CCN(C)C1CC(C)(C)NC(C)(C)C1.
What is the InChIKey of N,2,2,6,6-pentamethyl-N-prop-2-enylpiperidin-4-amine?
The InChIKey is HTOCUEIDXVYZAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2/c1-7-8-15(6)11-9-12(2,3)14-13(4,5)10-11/h7,11,14H,1,8-10H2,2-6H3.
What are the key properties of N,2,2,6,6-pentamethyl-N-prop-2-enylpiperidin-4-amine?
N,2,2,6,6-pentamethyl-N-prop-2-enylpiperidin-4-amine has a molecular weight of 210.36 g/mol, XLogP of 2.41, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,2,2,6,6-pentamethyl-N-prop-2-enylpiperidin-4-amine is sourced from PubChem (CID 18619904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).