3-methoxy-2-methyl-5-methylidenepiperidine

C8H15NO — CID 123429567

IUPAC3-methoxy-2-methyl-5-methylidenepiperidine
SMILESC=C1CNC(C)C(OC)C1
InChIInChI=1S/C8H15NO/c1-6-4-8(10-3)7(2)9-5-6/h7-9H,1,4-5H2,2-3H3
InChIKeyAHIUTFRNLNMKHA-UHFFFAOYSA-N
MW141.21 g/mol
LogP0.94
Rot. Bonds1

About 3-methoxy-2-methyl-5-methylidenepiperidine

3-methoxy-2-methyl-5-methylidenepiperidine (PubChem CID 123429567) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is 3-methoxy-2-methyl-5-methylidenepiperidine.

Molecular Properties

Compound Name3-methoxy-2-methyl-5-methylidenepiperidine
PubChem CID123429567
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC Name3-methoxy-2-methyl-5-methylidenepiperidine
SMILESC=C1CNC(C)C(OC)C1
InChIInChI=1S/C8H15NO/c1-6-4-8(10-3)7(2)9-5-6/h7-9H,1,4-5H2,2-3H3
InChIKeyAHIUTFRNLNMKHA-UHFFFAOYSA-N
XLogP0.94
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.21
LogP ≤ 50.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-Methyl-6-(2,3,6-trimethylmorpholin-4-yl)hept-1-en-3-amine
CID 89073923
3-Methoxy-5-methylidenepiperidine
CID 90772001
3-Ethoxy-5-methylidenepiperidine
CID 91444845
2-(2-Methylprop-2-enyl)morpholine
CID 91553690
3-Ethenyl-2-ethylmorpholine
CID 123930146
2,3-Dimethoxy-5-methylidenepiperidine
CID 123941739
(2S)-2-(1-methoxyethenyl)piperidine
CID 145493210
3-[(E)-but-2-en-2-yl]-2-ethyl-5,5-dimethylmorpholine
CID 15315812
N-ethyl-2-methyl-1-(4-methylmorpholin-2-yl)prop-2-en-1-amine
CID 79177326
2-methyl-1-(4-methylmorpholin-2-yl)-N-propylprop-2-en-1-amine
CID 79177542
2-Methyl-1-(4-methylmorpholin-2-yl)prop-2-en-1-amine
CID 79180133
N,2-dimethyl-1-(4-methylmorpholin-2-yl)prop-2-en-1-amine
CID 79180294

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-2-methyl-5-methylidenepiperidine?
The IUPAC name of 3-methoxy-2-methyl-5-methylidenepiperidine (CID 123429567) is 3-methoxy-2-methyl-5-methylidenepiperidine.
What is the SMILES notation for 3-methoxy-2-methyl-5-methylidenepiperidine?
The canonical SMILES for 3-methoxy-2-methyl-5-methylidenepiperidine is C=C1CNC(C)C(OC)C1.
What is the InChIKey of 3-methoxy-2-methyl-5-methylidenepiperidine?
The InChIKey is AHIUTFRNLNMKHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO/c1-6-4-8(10-3)7(2)9-5-6/h7-9H,1,4-5H2,2-3H3.
What are the key properties of 3-methoxy-2-methyl-5-methylidenepiperidine?
3-methoxy-2-methyl-5-methylidenepiperidine has a molecular weight of 141.21 g/mol, XLogP of 0.94, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-2-methyl-5-methylidenepiperidine is sourced from PubChem (CID 123429567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).