4-ethenyl-4-ethyl-1,2-dimethylpiperidine

C11H21N — CID 167284042

IUPAC4-ethenyl-4-ethyl-1,2-dimethylpiperidine
SMILESC=CC1(CC)CCN(C)C(C)C1
InChIInChI=1S/C11H21N/c1-5-11(6-2)7-8-12(4)10(3)9-11/h5,10H,1,6-9H2,2-4H3
InChIKeyRWSSLIMAKZOFNN-UHFFFAOYSA-N
MW167.30 g/mol
LogP2.68
Rot. Bonds2

About 4-ethenyl-4-ethyl-1,2-dimethylpiperidine

4-ethenyl-4-ethyl-1,2-dimethylpiperidine (PubChem CID 167284042) has the molecular formula C11H21N and a molecular weight of 167.30 g/mol. Its IUPAC name is 4-ethenyl-4-ethyl-1,2-dimethylpiperidine.

Molecular Properties

Compound Name4-ethenyl-4-ethyl-1,2-dimethylpiperidine
PubChem CID167284042
Molecular FormulaC11H21N
Molecular Weight167.30 g/mol
Exact Mass167.17
IUPAC Name4-ethenyl-4-ethyl-1,2-dimethylpiperidine
SMILESC=CC1(CC)CCN(C)C(C)C1
InChIInChI=1S/C11H21N/c1-5-11(6-2)7-8-12(4)10(3)9-11/h5,10H,1,6-9H2,2-4H3
InChIKeyRWSSLIMAKZOFNN-UHFFFAOYSA-N
XLogP2.68
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.30
LogP ≤ 52.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-ethenyl-4-ethyl-1,2-dimethylpiperidine?
The IUPAC name of 4-ethenyl-4-ethyl-1,2-dimethylpiperidine (CID 167284042) is 4-ethenyl-4-ethyl-1,2-dimethylpiperidine.
What is the SMILES notation for 4-ethenyl-4-ethyl-1,2-dimethylpiperidine?
The canonical SMILES for 4-ethenyl-4-ethyl-1,2-dimethylpiperidine is C=CC1(CC)CCN(C)C(C)C1.
What is the InChIKey of 4-ethenyl-4-ethyl-1,2-dimethylpiperidine?
The InChIKey is RWSSLIMAKZOFNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N/c1-5-11(6-2)7-8-12(4)10(3)9-11/h5,10H,1,6-9H2,2-4H3.
What are the key properties of 4-ethenyl-4-ethyl-1,2-dimethylpiperidine?
4-ethenyl-4-ethyl-1,2-dimethylpiperidine has a molecular weight of 167.30 g/mol, XLogP of 2.68, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethenyl-4-ethyl-1,2-dimethylpiperidine is sourced from PubChem (CID 167284042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).