1-ethyl-2,3-dimethylidenepiperidine

C9H15N — CID 89312028

IUPAC1-ethyl-2,3-dimethylidenepiperidine
SMILESC=C1CCCN(CC)C1=C
InChIInChI=1S/C9H15N/c1-4-10-7-5-6-8(2)9(10)3/h2-7H2,1H3
InChIKeyYNQFHFOVWRUAON-UHFFFAOYSA-N
MW137.23 g/mol
LogP2.17
Rot. Bonds1

About 1-ethyl-2,3-dimethylidenepiperidine

1-ethyl-2,3-dimethylidenepiperidine (PubChem CID 89312028) has the molecular formula C9H15N and a molecular weight of 137.23 g/mol. Its IUPAC name is 1-ethyl-2,3-dimethylidenepiperidine.

Molecular Properties

Compound Name1-ethyl-2,3-dimethylidenepiperidine
PubChem CID89312028
Molecular FormulaC9H15N
Molecular Weight137.23 g/mol
Exact Mass137.12
IUPAC Name1-ethyl-2,3-dimethylidenepiperidine
SMILESC=C1CCCN(CC)C1=C
InChIInChI=1S/C9H15N/c1-4-10-7-5-6-8(2)9(10)3/h2-7H2,1H3
InChIKeyYNQFHFOVWRUAON-UHFFFAOYSA-N
XLogP2.17
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.23
LogP ≤ 52.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-2,3-dimethylidenepiperidine?
The IUPAC name of 1-ethyl-2,3-dimethylidenepiperidine (CID 89312028) is 1-ethyl-2,3-dimethylidenepiperidine.
What is the SMILES notation for 1-ethyl-2,3-dimethylidenepiperidine?
The canonical SMILES for 1-ethyl-2,3-dimethylidenepiperidine is C=C1CCCN(CC)C1=C.
What is the InChIKey of 1-ethyl-2,3-dimethylidenepiperidine?
The InChIKey is YNQFHFOVWRUAON-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N/c1-4-10-7-5-6-8(2)9(10)3/h2-7H2,1H3.
What are the key properties of 1-ethyl-2,3-dimethylidenepiperidine?
1-ethyl-2,3-dimethylidenepiperidine has a molecular weight of 137.23 g/mol, XLogP of 2.17, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-2,3-dimethylidenepiperidine is sourced from PubChem (CID 89312028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).