2-methoxy-3-methyl-5-methylidenepiperidine

C8H15NO — CID 91145347

IUPAC2-methoxy-3-methyl-5-methylidenepiperidine
SMILESC=C1CNC(OC)C(C)C1
InChIInChI=1S/C8H15NO/c1-6-4-7(2)8(10-3)9-5-6/h7-9H,1,4-5H2,2-3H3
InChIKeyLIVTUFYDGODCSO-UHFFFAOYSA-N
MW141.21 g/mol
LogP1.14
Rot. Bonds1

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

2-methoxy-3-methyl-5-methylidenepiperidine (PubChem CID 91145347) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is 2-methoxy-3-methyl-5-methylidenepiperidine.

Molecular Properties

Compound Name2-methoxy-3-methyl-5-methylidenepiperidine
PubChem CID91145347
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC Name2-methoxy-3-methyl-5-methylidenepiperidine
SMILESC=C1CNC(OC)C(C)C1
InChIInChI=1S/C8H15NO/c1-6-4-7(2)8(10-3)9-5-6/h7-9H,1,4-5H2,2-3H3
InChIKeyLIVTUFYDGODCSO-UHFFFAOYSA-N
XLogP1.14
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 ≤ 51.14
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

3-Fluoro-2-methoxy-5-methylidenepiperidine
CID 90934404
2-Ethoxy-3-methylidenepiperidine
CID 91046560
2-Methoxy-3-methylidenepiperidine
CID 91124723
2-Methoxy-5-methylidenepiperidine-3-carbonitrile
CID 91171504
3-Methyl-5-methylidenepiperidin-2-ol
CID 91350015
2-Methoxy-5-methylidenepiperidine
CID 91437785
5-methylidene-4,6,7,7a-tetrahydro-3aH-furo[2,3-b]pyridine
CID 91475611
2-methylidene-N-(oxan-3-ylmethyl)butan-1-amine
CID 66047355
3-methyl-N-(oxan-3-ylmethyl)but-3-en-1-amine
CID 114472105
3-(3-Methylbut-3-enoxymethyl)piperidine
CID 114473046
(3R)-3-(1-methoxyethenyl)piperidine
CID 145539536

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-3-methyl-5-methylidenepiperidine?
The IUPAC name of 2-methoxy-3-methyl-5-methylidenepiperidine (CID 91145347) is 2-methoxy-3-methyl-5-methylidenepiperidine.
What is the SMILES notation for 2-methoxy-3-methyl-5-methylidenepiperidine?
The canonical SMILES for 2-methoxy-3-methyl-5-methylidenepiperidine is C=C1CNC(OC)C(C)C1.
What is the InChIKey of 2-methoxy-3-methyl-5-methylidenepiperidine?
The InChIKey is LIVTUFYDGODCSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO/c1-6-4-7(2)8(10-3)9-5-6/h7-9H,1,4-5H2,2-3H3.
What are the key properties of 2-methoxy-3-methyl-5-methylidenepiperidine?
2-methoxy-3-methyl-5-methylidenepiperidine has a molecular weight of 141.21 g/mol, XLogP of 1.14, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-3-methyl-5-methylidenepiperidine is sourced from PubChem (CID 91145347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).