2-tert-butyl-6-methylidenepiperidine

C10H19N — CID 59464695

IUPAC2-tert-butyl-6-methylidenepiperidine
SMILESC=C1CCCC(C(C)(C)C)N1
InChIInChI=1S/C10H19N/c1-8-6-5-7-9(11-8)10(2,3)4/h9,11H,1,5-7H2,2-4H3
InChIKeyPEXRSOVUMFHVOA-UHFFFAOYSA-N
MW153.27 g/mol
LogP2.69
Rot. Bonds

About 2-tert-butyl-6-methylidenepiperidine

2-tert-butyl-6-methylidenepiperidine (PubChem CID 59464695) has the molecular formula C10H19N and a molecular weight of 153.27 g/mol. Its IUPAC name is 2-tert-butyl-6-methylidenepiperidine.

Molecular Properties

Compound Name2-tert-butyl-6-methylidenepiperidine
PubChem CID59464695
Molecular FormulaC10H19N
Molecular Weight153.27 g/mol
Exact Mass153.15
IUPAC Name2-tert-butyl-6-methylidenepiperidine
SMILESC=C1CCCC(C(C)(C)C)N1
InChIInChI=1S/C10H19N/c1-8-6-5-7-9(11-8)10(2,3)4/h9,11H,1,5-7H2,2-4H3
InChIKeyPEXRSOVUMFHVOA-UHFFFAOYSA-N
XLogP2.69
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.27
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-tert-butyl-6-methylidenepiperidine?
The IUPAC name of 2-tert-butyl-6-methylidenepiperidine (CID 59464695) is 2-tert-butyl-6-methylidenepiperidine.
What is the SMILES notation for 2-tert-butyl-6-methylidenepiperidine?
The canonical SMILES for 2-tert-butyl-6-methylidenepiperidine is C=C1CCCC(C(C)(C)C)N1.
What is the InChIKey of 2-tert-butyl-6-methylidenepiperidine?
The InChIKey is PEXRSOVUMFHVOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N/c1-8-6-5-7-9(11-8)10(2,3)4/h9,11H,1,5-7H2,2-4H3.
What are the key properties of 2-tert-butyl-6-methylidenepiperidine?
2-tert-butyl-6-methylidenepiperidine has a molecular weight of 153.27 g/mol, XLogP of 2.69, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-tert-butyl-6-methylidenepiperidine is sourced from PubChem (CID 59464695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).