4-tert-butyl-1-methyl-2-methylidenepiperidine

C11H21N — CID 118424445

IUPAC4-tert-butyl-1-methyl-2-methylidenepiperidine
SMILESC=C1CC(C(C)(C)C)CCN1C
InChIInChI=1S/C11H21N/c1-9-8-10(11(2,3)4)6-7-12(9)5/h10H,1,6-8H2,2-5H3
InChIKeyDRLPFIMHYYYJCH-UHFFFAOYSA-N
MW167.30 g/mol
LogP2.89
Rot. Bonds

About 4-tert-butyl-1-methyl-2-methylidenepiperidine

4-tert-butyl-1-methyl-2-methylidenepiperidine (PubChem CID 118424445) has the molecular formula C11H21N and a molecular weight of 167.30 g/mol. Its IUPAC name is 4-tert-butyl-1-methyl-2-methylidenepiperidine.

Molecular Properties

Compound Name4-tert-butyl-1-methyl-2-methylidenepiperidine
PubChem CID118424445
Molecular FormulaC11H21N
Molecular Weight167.30 g/mol
Exact Mass167.17
IUPAC Name4-tert-butyl-1-methyl-2-methylidenepiperidine
SMILESC=C1CC(C(C)(C)C)CCN1C
InChIInChI=1S/C11H21N/c1-9-8-10(11(2,3)4)6-7-12(9)5/h10H,1,6-8H2,2-5H3
InChIKeyDRLPFIMHYYYJCH-UHFFFAOYSA-N
XLogP2.89
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 ≤ 52.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-tert-butyl-1-methyl-2-methylidenepiperidine?
The IUPAC name of 4-tert-butyl-1-methyl-2-methylidenepiperidine (CID 118424445) is 4-tert-butyl-1-methyl-2-methylidenepiperidine.
What is the SMILES notation for 4-tert-butyl-1-methyl-2-methylidenepiperidine?
The canonical SMILES for 4-tert-butyl-1-methyl-2-methylidenepiperidine is C=C1CC(C(C)(C)C)CCN1C.
What is the InChIKey of 4-tert-butyl-1-methyl-2-methylidenepiperidine?
The InChIKey is DRLPFIMHYYYJCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N/c1-9-8-10(11(2,3)4)6-7-12(9)5/h10H,1,6-8H2,2-5H3.
What are the key properties of 4-tert-butyl-1-methyl-2-methylidenepiperidine?
4-tert-butyl-1-methyl-2-methylidenepiperidine has a molecular weight of 167.30 g/mol, XLogP of 2.89, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-tert-butyl-1-methyl-2-methylidenepiperidine is sourced from PubChem (CID 118424445), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).