3,4-dimethylidenepiperidine

C7H11N — CID 21412354

IUPAC3,4-dimethylidenepiperidine
SMILESC=C1CCNCC1=C
InChIInChI=1S/C7H11N/c1-6-3-4-8-5-7(6)2/h8H,1-5H2
InChIKeyAQMLOVJUWHKDIG-UHFFFAOYSA-N
MW109.17 g/mol
LogP1.09
Rot. Bonds

About 3,4-dimethylidenepiperidine

3,4-dimethylidenepiperidine (PubChem CID 21412354) has the molecular formula C7H11N and a molecular weight of 109.17 g/mol. Its IUPAC name is 3,4-dimethylidenepiperidine.

Molecular Properties

Compound Name3,4-dimethylidenepiperidine
PubChem CID21412354
Molecular FormulaC7H11N
Molecular Weight109.17 g/mol
Exact Mass109.09
IUPAC Name3,4-dimethylidenepiperidine
SMILESC=C1CCNCC1=C
InChIInChI=1S/C7H11N/c1-6-3-4-8-5-7(6)2/h8H,1-5H2
InChIKeyAQMLOVJUWHKDIG-UHFFFAOYSA-N
XLogP1.09
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500109.17
LogP ≤ 51.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3,4-dimethylidenepiperidine?
The IUPAC name of 3,4-dimethylidenepiperidine (CID 21412354) is 3,4-dimethylidenepiperidine.
What is the SMILES notation for 3,4-dimethylidenepiperidine?
The canonical SMILES for 3,4-dimethylidenepiperidine is C=C1CCNCC1=C.
What is the InChIKey of 3,4-dimethylidenepiperidine?
The InChIKey is AQMLOVJUWHKDIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N/c1-6-3-4-8-5-7(6)2/h8H,1-5H2.
What are the key properties of 3,4-dimethylidenepiperidine?
3,4-dimethylidenepiperidine has a molecular weight of 109.17 g/mol, XLogP of 1.09, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dimethylidenepiperidine is sourced from PubChem (CID 21412354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).