1-ethenyl-4,4-dimethylpiperidine

C9H17N — CID 130438764

IUPAC1-ethenyl-4,4-dimethylpiperidine
SMILESC=CN1CCC(C)(C)CC1
InChIInChI=1S/C9H17N/c1-4-10-7-5-9(2,3)6-8-10/h4H,1,5-8H2,2-3H3
InChIKeyZLFSFBOWLZFDLJ-UHFFFAOYSA-N
MW139.24 g/mol
LogP2.25
Rot. Bonds1

About 1-ethenyl-4,4-dimethylpiperidine

1-ethenyl-4,4-dimethylpiperidine (PubChem CID 130438764) has the molecular formula C9H17N and a molecular weight of 139.24 g/mol. Its IUPAC name is 1-ethenyl-4,4-dimethylpiperidine.

Molecular Properties

Compound Name1-ethenyl-4,4-dimethylpiperidine
PubChem CID130438764
Molecular FormulaC9H17N
Molecular Weight139.24 g/mol
Exact Mass139.14
IUPAC Name1-ethenyl-4,4-dimethylpiperidine
SMILESC=CN1CCC(C)(C)CC1
InChIInChI=1S/C9H17N/c1-4-10-7-5-9(2,3)6-8-10/h4H,1,5-8H2,2-3H3
InChIKeyZLFSFBOWLZFDLJ-UHFFFAOYSA-N
XLogP2.25
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.24
LogP ≤ 52.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-ethenyl-4,4-dimethylpiperidine?
The IUPAC name of 1-ethenyl-4,4-dimethylpiperidine (CID 130438764) is 1-ethenyl-4,4-dimethylpiperidine.
What is the SMILES notation for 1-ethenyl-4,4-dimethylpiperidine?
The canonical SMILES for 1-ethenyl-4,4-dimethylpiperidine is C=CN1CCC(C)(C)CC1.
What is the InChIKey of 1-ethenyl-4,4-dimethylpiperidine?
The InChIKey is ZLFSFBOWLZFDLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N/c1-4-10-7-5-9(2,3)6-8-10/h4H,1,5-8H2,2-3H3.
What are the key properties of 1-ethenyl-4,4-dimethylpiperidine?
1-ethenyl-4,4-dimethylpiperidine has a molecular weight of 139.24 g/mol, XLogP of 2.25, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethenyl-4,4-dimethylpiperidine is sourced from PubChem (CID 130438764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).