2,3,4,5-tetramethylidenepiperidine

C9H11N — CID 19980188

IUPAC2,3,4,5-tetramethylidenepiperidine
SMILESC=C1CNC(=C)C(=C)C1=C
InChIInChI=1S/C9H11N/c1-6-5-10-9(4)8(3)7(6)2/h10H,1-5H2
InChIKeySRDOLYJBDQYVKE-UHFFFAOYSA-N
MW133.19 g/mol
LogP1.77
Rot. Bonds

About 2,3,4,5-tetramethylidenepiperidine

2,3,4,5-tetramethylidenepiperidine (PubChem CID 19980188) has the molecular formula C9H11N and a molecular weight of 133.19 g/mol. Its IUPAC name is 2,3,4,5-tetramethylidenepiperidine.

Molecular Properties

Compound Name2,3,4,5-tetramethylidenepiperidine
PubChem CID19980188
Molecular FormulaC9H11N
Molecular Weight133.19 g/mol
Exact Mass133.09
IUPAC Name2,3,4,5-tetramethylidenepiperidine
SMILESC=C1CNC(=C)C(=C)C1=C
InChIInChI=1S/C9H11N/c1-6-5-10-9(4)8(3)7(6)2/h10H,1-5H2
InChIKeySRDOLYJBDQYVKE-UHFFFAOYSA-N
XLogP1.77
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500133.19
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,3,4,5-tetramethylidenepiperidine?
The IUPAC name of 2,3,4,5-tetramethylidenepiperidine (CID 19980188) is 2,3,4,5-tetramethylidenepiperidine.
What is the SMILES notation for 2,3,4,5-tetramethylidenepiperidine?
The canonical SMILES for 2,3,4,5-tetramethylidenepiperidine is C=C1CNC(=C)C(=C)C1=C.
What is the InChIKey of 2,3,4,5-tetramethylidenepiperidine?
The InChIKey is SRDOLYJBDQYVKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N/c1-6-5-10-9(4)8(3)7(6)2/h10H,1-5H2.
What are the key properties of 2,3,4,5-tetramethylidenepiperidine?
2,3,4,5-tetramethylidenepiperidine has a molecular weight of 133.19 g/mol, XLogP of 1.77, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,4,5-tetramethylidenepiperidine is sourced from PubChem (CID 19980188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).