1,2-dimethyl-6-methylidene-4-octylpiperidine

C16H31N — CID 154946082

IUPAC1,2-dimethyl-6-methylidene-4-octylpiperidine
SMILESC=C1CC(CCCCCCCC)CC(C)N1C
InChIInChI=1S/C16H31N/c1-5-6-7-8-9-10-11-16-12-14(2)17(4)15(3)13-16/h15-16H,2,5-13H2,1,3-4H3
InChIKeyWFLGPEGMURUZDY-UHFFFAOYSA-N
MW237.43 g/mol
LogP4.98
Rot. Bonds7

About 1,2-dimethyl-6-methylidene-4-octylpiperidine

1,2-dimethyl-6-methylidene-4-octylpiperidine (PubChem CID 154946082) has the molecular formula C16H31N and a molecular weight of 237.43 g/mol. Its IUPAC name is 1,2-dimethyl-6-methylidene-4-octylpiperidine.

Molecular Properties

Compound Name1,2-dimethyl-6-methylidene-4-octylpiperidine
PubChem CID154946082
Molecular FormulaC16H31N
Molecular Weight237.43 g/mol
Exact Mass237.25
IUPAC Name1,2-dimethyl-6-methylidene-4-octylpiperidine
SMILESC=C1CC(CCCCCCCC)CC(C)N1C
InChIInChI=1S/C16H31N/c1-5-6-7-8-9-10-11-16-12-14(2)17(4)15(3)13-16/h15-16H,2,5-13H2,1,3-4H3
InChIKeyWFLGPEGMURUZDY-UHFFFAOYSA-N
XLogP4.98
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.43
LogP ≤ 54.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1,2-dimethyl-6-methylidene-4-octylpiperidine?
The IUPAC name of 1,2-dimethyl-6-methylidene-4-octylpiperidine (CID 154946082) is 1,2-dimethyl-6-methylidene-4-octylpiperidine.
What is the SMILES notation for 1,2-dimethyl-6-methylidene-4-octylpiperidine?
The canonical SMILES for 1,2-dimethyl-6-methylidene-4-octylpiperidine is C=C1CC(CCCCCCCC)CC(C)N1C.
What is the InChIKey of 1,2-dimethyl-6-methylidene-4-octylpiperidine?
The InChIKey is WFLGPEGMURUZDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31N/c1-5-6-7-8-9-10-11-16-12-14(2)17(4)15(3)13-16/h15-16H,2,5-13H2,1,3-4H3.
What are the key properties of 1,2-dimethyl-6-methylidene-4-octylpiperidine?
1,2-dimethyl-6-methylidene-4-octylpiperidine has a molecular weight of 237.43 g/mol, XLogP of 4.98, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-dimethyl-6-methylidene-4-octylpiperidine is sourced from PubChem (CID 154946082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).