ethane;4-(2-methoxyethylidene)-1-methylpiperidine

C11H23NO — CID 143832103

IUPACethane;4-(2-methoxyethylidene)-1-methylpiperidine
SMILESCC.COCC=C1CCN(C)CC1
InChIInChI=1S/C9H17NO.C2H6/c1-10-6-3-9(4-7-10)5-8-11-2;1-2/h5H,3-4,6-8H2,1-2H3;1-2H3
InChIKeyILZWEUWLCGFADO-UHFFFAOYSA-N
MW185.31 g/mol
LogP2.31
Rot. Bonds2

About ethane;4-(2-methoxyethylidene)-1-methylpiperidine

ethane;4-(2-methoxyethylidene)-1-methylpiperidine (PubChem CID 143832103) has the molecular formula C11H23NO and a molecular weight of 185.31 g/mol. Its IUPAC name is ethane;4-(2-methoxyethylidene)-1-methylpiperidine.

Molecular Properties

Compound Nameethane;4-(2-methoxyethylidene)-1-methylpiperidine
PubChem CID143832103
Molecular FormulaC11H23NO
Molecular Weight185.31 g/mol
Exact Mass185.18
IUPAC Nameethane;4-(2-methoxyethylidene)-1-methylpiperidine
SMILESCC.COCC=C1CCN(C)CC1
InChIInChI=1S/C9H17NO.C2H6/c1-10-6-3-9(4-7-10)5-8-11-2;1-2/h5H,3-4,6-8H2,1-2H3;1-2H3
InChIKeyILZWEUWLCGFADO-UHFFFAOYSA-N
XLogP2.31
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 52.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-Ethyl-4-methoxymethyl-1,2,3,6-tetrahydropyridine
CID 14442214
4-(1-methoxyethyl)-1-methyl-3,6-dihydro-2H-pyridine
CID 14442221
4-(methoxymethyl)-1,1-dimethyl-3,6-dihydro-2H-pyridin-1-ium
CID 14442230
2-(1-Butylpiperidin-4-ylidene)ethanol
CID 18695481
4-(2-Ethylperoxyethylidene)-1-methylpiperidine
CID 53794828
4-(4-Methoxybutylidene)-1-methylpiperidine
CID 57528384
4-(2-Methoxyethylidene)-1-methylpiperidine
CID 59255536
N-butyl-2-(2-methoxyethylidene)-N-methylcyclohexan-1-amine
CID 70432496
1-(3,6-dihydro-2H-pyran-2-yl)piperidine
CID 90897325
4-(2-Methoxyethylidene)piperidine
CID 115011443
6-methoxy-1,4-dimethyl-3,6-dihydro-2H-pyridine
CID 123353330
(2E)-N-butyl-2-(2-methoxyethylidene)-N-methylcyclohexan-1-amine
CID 140339732

Frequently Asked Questions

What is the IUPAC name of ethane;4-(2-methoxyethylidene)-1-methylpiperidine?
The IUPAC name of ethane;4-(2-methoxyethylidene)-1-methylpiperidine (CID 143832103) is ethane;4-(2-methoxyethylidene)-1-methylpiperidine.
What is the SMILES notation for ethane;4-(2-methoxyethylidene)-1-methylpiperidine?
The canonical SMILES for ethane;4-(2-methoxyethylidene)-1-methylpiperidine is CC.COCC=C1CCN(C)CC1.
What is the InChIKey of ethane;4-(2-methoxyethylidene)-1-methylpiperidine?
The InChIKey is ILZWEUWLCGFADO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO.C2H6/c1-10-6-3-9(4-7-10)5-8-11-2;1-2/h5H,3-4,6-8H2,1-2H3;1-2H3.
What are the key properties of ethane;4-(2-methoxyethylidene)-1-methylpiperidine?
ethane;4-(2-methoxyethylidene)-1-methylpiperidine has a molecular weight of 185.31 g/mol, XLogP of 2.31, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;4-(2-methoxyethylidene)-1-methylpiperidine is sourced from PubChem (CID 143832103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).