1-ethenyl-3,5-dimethylpiperidine

C9H17N — CID 89325072

IUPAC1-ethenyl-3,5-dimethylpiperidine
SMILESC=CN1CC(C)CC(C)C1
InChIInChI=1S/C9H17N/c1-4-10-6-8(2)5-9(3)7-10/h4,8-9H,1,5-7H2,2-3H3
InChIKeyOSESKEPWDKQZAQ-UHFFFAOYSA-N
MW139.24 g/mol
LogP2.11
Rot. Bonds1

About 1-ethenyl-3,5-dimethylpiperidine

1-ethenyl-3,5-dimethylpiperidine (PubChem CID 89325072) has the molecular formula C9H17N and a molecular weight of 139.24 g/mol. Its IUPAC name is 1-ethenyl-3,5-dimethylpiperidine.

Molecular Properties

Compound Name1-ethenyl-3,5-dimethylpiperidine
PubChem CID89325072
Molecular FormulaC9H17N
Molecular Weight139.24 g/mol
Exact Mass139.14
IUPAC Name1-ethenyl-3,5-dimethylpiperidine
SMILESC=CN1CC(C)CC(C)C1
InChIInChI=1S/C9H17N/c1-4-10-6-8(2)5-9(3)7-10/h4,8-9H,1,5-7H2,2-3H3
InChIKeyOSESKEPWDKQZAQ-UHFFFAOYSA-N
XLogP2.11
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 ≤ 52.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-ethenyl-3,5-dimethylpiperidine?
The IUPAC name of 1-ethenyl-3,5-dimethylpiperidine (CID 89325072) is 1-ethenyl-3,5-dimethylpiperidine.
What is the SMILES notation for 1-ethenyl-3,5-dimethylpiperidine?
The canonical SMILES for 1-ethenyl-3,5-dimethylpiperidine is C=CN1CC(C)CC(C)C1.
What is the InChIKey of 1-ethenyl-3,5-dimethylpiperidine?
The InChIKey is OSESKEPWDKQZAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N/c1-4-10-6-8(2)5-9(3)7-10/h4,8-9H,1,5-7H2,2-3H3.
What are the key properties of 1-ethenyl-3,5-dimethylpiperidine?
1-ethenyl-3,5-dimethylpiperidine has a molecular weight of 139.24 g/mol, XLogP of 2.11, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethenyl-3,5-dimethylpiperidine is sourced from PubChem (CID 89325072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).