1,2,2,6,6-pentamethyl-4-methylidenepiperidine

C11H21N — CID 58902709

IUPAC1,2,2,6,6-pentamethyl-4-methylidenepiperidine
SMILESC=C1CC(C)(C)N(C)C(C)(C)C1
InChIInChI=1S/C11H21N/c1-9-7-10(2,3)12(6)11(4,5)8-9/h1,7-8H2,2-6H3
InChIKeyYMPMVORHAFYIIY-UHFFFAOYSA-N
MW167.30 g/mol
LogP2.83
Rot. Bonds

About 1,2,2,6,6-pentamethyl-4-methylidenepiperidine

1,2,2,6,6-pentamethyl-4-methylidenepiperidine (PubChem CID 58902709) has the molecular formula C11H21N and a molecular weight of 167.30 g/mol. Its IUPAC name is 1,2,2,6,6-pentamethyl-4-methylidenepiperidine.

Molecular Properties

Compound Name1,2,2,6,6-pentamethyl-4-methylidenepiperidine
PubChem CID58902709
Molecular FormulaC11H21N
Molecular Weight167.30 g/mol
Exact Mass167.17
IUPAC Name1,2,2,6,6-pentamethyl-4-methylidenepiperidine
SMILESC=C1CC(C)(C)N(C)C(C)(C)C1
InChIInChI=1S/C11H21N/c1-9-7-10(2,3)12(6)11(4,5)8-9/h1,7-8H2,2-6H3
InChIKeyYMPMVORHAFYIIY-UHFFFAOYSA-N
XLogP2.83
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.30
LogP ≤ 52.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 1,2,2,6,6-pentamethyl-4-methylidenepiperidine?
The IUPAC name of 1,2,2,6,6-pentamethyl-4-methylidenepiperidine (CID 58902709) is 1,2,2,6,6-pentamethyl-4-methylidenepiperidine.
What is the SMILES notation for 1,2,2,6,6-pentamethyl-4-methylidenepiperidine?
The canonical SMILES for 1,2,2,6,6-pentamethyl-4-methylidenepiperidine is C=C1CC(C)(C)N(C)C(C)(C)C1.
What is the InChIKey of 1,2,2,6,6-pentamethyl-4-methylidenepiperidine?
The InChIKey is YMPMVORHAFYIIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N/c1-9-7-10(2,3)12(6)11(4,5)8-9/h1,7-8H2,2-6H3.
What are the key properties of 1,2,2,6,6-pentamethyl-4-methylidenepiperidine?
1,2,2,6,6-pentamethyl-4-methylidenepiperidine has a molecular weight of 167.30 g/mol, XLogP of 2.83, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,2,6,6-pentamethyl-4-methylidenepiperidine is sourced from PubChem (CID 58902709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).