1,4-ditert-butyl-2-methylidenepiperidine

C14H27N — CID 90134432

IUPAC1,4-ditert-butyl-2-methylidenepiperidine
SMILESC=C1CC(C(C)(C)C)CCN1C(C)(C)C
InChIInChI=1S/C14H27N/c1-11-10-12(13(2,3)4)8-9-15(11)14(5,6)7/h12H,1,8-10H2,2-7H3
InChIKeySJZLBUZFNKGFPG-UHFFFAOYSA-N
MW209.38 g/mol
LogP4.06
Rot. Bonds

About 1,4-ditert-butyl-2-methylidenepiperidine

1,4-ditert-butyl-2-methylidenepiperidine (PubChem CID 90134432) has the molecular formula C14H27N and a molecular weight of 209.38 g/mol. Its IUPAC name is 1,4-ditert-butyl-2-methylidenepiperidine.

Molecular Properties

Compound Name1,4-ditert-butyl-2-methylidenepiperidine
PubChem CID90134432
Molecular FormulaC14H27N
Molecular Weight209.38 g/mol
Exact Mass209.21
IUPAC Name1,4-ditert-butyl-2-methylidenepiperidine
SMILESC=C1CC(C(C)(C)C)CCN1C(C)(C)C
InChIInChI=1S/C14H27N/c1-11-10-12(13(2,3)4)8-9-15(11)14(5,6)7/h12H,1,8-10H2,2-7H3
InChIKeySJZLBUZFNKGFPG-UHFFFAOYSA-N
XLogP4.06
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.38
LogP ≤ 54.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1,4-ditert-butyl-2-methylidenepiperidine?
The IUPAC name of 1,4-ditert-butyl-2-methylidenepiperidine (CID 90134432) is 1,4-ditert-butyl-2-methylidenepiperidine.
What is the SMILES notation for 1,4-ditert-butyl-2-methylidenepiperidine?
The canonical SMILES for 1,4-ditert-butyl-2-methylidenepiperidine is C=C1CC(C(C)(C)C)CCN1C(C)(C)C.
What is the InChIKey of 1,4-ditert-butyl-2-methylidenepiperidine?
The InChIKey is SJZLBUZFNKGFPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N/c1-11-10-12(13(2,3)4)8-9-15(11)14(5,6)7/h12H,1,8-10H2,2-7H3.
What are the key properties of 1,4-ditert-butyl-2-methylidenepiperidine?
1,4-ditert-butyl-2-methylidenepiperidine has a molecular weight of 209.38 g/mol, XLogP of 4.06, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-ditert-butyl-2-methylidenepiperidine is sourced from PubChem (CID 90134432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).