5-tert-butyl-2-methylidenepiperidine

C10H19N — CID 59464696

IUPAC5-tert-butyl-2-methylidenepiperidine
SMILESC=C1CCC(C(C)(C)C)CN1
InChIInChI=1S/C10H19N/c1-8-5-6-9(7-11-8)10(2,3)4/h9,11H,1,5-7H2,2-4H3
InChIKeyLNASWVZXLXMLDP-UHFFFAOYSA-N
MW153.27 g/mol
LogP2.55
Rot. Bonds

About 5-tert-butyl-2-methylidenepiperidine

5-tert-butyl-2-methylidenepiperidine (PubChem CID 59464696) has the molecular formula C10H19N and a molecular weight of 153.27 g/mol. Its IUPAC name is 5-tert-butyl-2-methylidenepiperidine.

Molecular Properties

Compound Name5-tert-butyl-2-methylidenepiperidine
PubChem CID59464696
Molecular FormulaC10H19N
Molecular Weight153.27 g/mol
Exact Mass153.15
IUPAC Name5-tert-butyl-2-methylidenepiperidine
SMILESC=C1CCC(C(C)(C)C)CN1
InChIInChI=1S/C10H19N/c1-8-5-6-9(7-11-8)10(2,3)4/h9,11H,1,5-7H2,2-4H3
InChIKeyLNASWVZXLXMLDP-UHFFFAOYSA-N
XLogP2.55
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 ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 5-tert-butyl-2-methylidenepiperidine?
The IUPAC name of 5-tert-butyl-2-methylidenepiperidine (CID 59464696) is 5-tert-butyl-2-methylidenepiperidine.
What is the SMILES notation for 5-tert-butyl-2-methylidenepiperidine?
The canonical SMILES for 5-tert-butyl-2-methylidenepiperidine is C=C1CCC(C(C)(C)C)CN1.
What is the InChIKey of 5-tert-butyl-2-methylidenepiperidine?
The InChIKey is LNASWVZXLXMLDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N/c1-8-5-6-9(7-11-8)10(2,3)4/h9,11H,1,5-7H2,2-4H3.
What are the key properties of 5-tert-butyl-2-methylidenepiperidine?
5-tert-butyl-2-methylidenepiperidine has a molecular weight of 153.27 g/mol, XLogP of 2.55, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-tert-butyl-2-methylidenepiperidine is sourced from PubChem (CID 59464696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).