lanthanum;4-(methoxymethyl)-4-prop-2-enylpiperidin-1-ide

C10H18LaNO- — CID 59312076

IUPAClanthanum;4-(methoxymethyl)-4-prop-2-enylpiperidin-1-ide
SMILESC=CCC1(COC)CC[N-]CC1.[La]
InChIInChI=1S/C10H18NO.La/c1-3-4-10(9-12-2)5-7-11-8-6-10;/h3H,1,4-9H2,2H3;/q-1;
InChIKeyOVYNXOPTAGTEIA-UHFFFAOYSA-N
MW307.17 g/mol
LogP2.36
Rot. Bonds4

About lanthanum;4-(methoxymethyl)-4-prop-2-enylpiperidin-1-ide

lanthanum;4-(methoxymethyl)-4-prop-2-enylpiperidin-1-ide (PubChem CID 59312076) has the molecular formula C10H18LaNO- and a molecular weight of 307.17 g/mol. Its IUPAC name is lanthanum;4-(methoxymethyl)-4-prop-2-enylpiperidin-1-ide.

Molecular Properties

Compound Namelanthanum;4-(methoxymethyl)-4-prop-2-enylpiperidin-1-ide
PubChem CID59312076
Molecular FormulaC10H18LaNO-
Molecular Weight307.17 g/mol
Exact Mass307.05
IUPAC Namelanthanum;4-(methoxymethyl)-4-prop-2-enylpiperidin-1-ide
SMILESC=CCC1(COC)CC[N-]CC1.[La]
InChIInChI=1S/C10H18NO.La/c1-3-4-10(9-12-2)5-7-11-8-6-10;/h3H,1,4-9H2,2H3;/q-1;
InChIKeyOVYNXOPTAGTEIA-UHFFFAOYSA-N
XLogP2.36
TPSA23.33 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.17
LogP ≤ 52.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze lanthanum;4-(methoxymethyl)-4-prop-2-enylpiperidin-1-ide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Lanthanum;(4-prop-2-enylpiperidin-1-id-4-yl)methanol
CID 59312011
1-[(E)-5-methoxy-4,4-dimethylpent-1-enyl]piperidine
CID 121340416
Methoxyethane;prop-1-ene;1,4,4-trimethylpiperidine
CID 142009450
[1-Methyl-4-(prop-2-en-1-yl)piperidin-4-yl]methanol
CID 143739834
4-(ethoxymethyl)-1-iodo-4-[(2Z)-penta-2,4-dienyl]piperidine
CID 144477582
Ethane;1-methyl-4-(1-propan-2-yloxyethenyl)-4-prop-2-enylpiperidine
CID 163236417
4-(Methoxymethyl)-4-prop-2-enylpiperidine
CID 59312077
1-Methyl-4-(1-propan-2-yloxyethenyl)-4-prop-2-enylpiperidine
CID 163236418

Frequently Asked Questions

What is the IUPAC name of lanthanum;4-(methoxymethyl)-4-prop-2-enylpiperidin-1-ide?
The IUPAC name of lanthanum;4-(methoxymethyl)-4-prop-2-enylpiperidin-1-ide (CID 59312076) is lanthanum;4-(methoxymethyl)-4-prop-2-enylpiperidin-1-ide.
What is the SMILES notation for lanthanum;4-(methoxymethyl)-4-prop-2-enylpiperidin-1-ide?
The canonical SMILES for lanthanum;4-(methoxymethyl)-4-prop-2-enylpiperidin-1-ide is C=CCC1(COC)CC[N-]CC1.[La].
What is the InChIKey of lanthanum;4-(methoxymethyl)-4-prop-2-enylpiperidin-1-ide?
The InChIKey is OVYNXOPTAGTEIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18NO.La/c1-3-4-10(9-12-2)5-7-11-8-6-10;/h3H,1,4-9H2,2H3;/q-1;.
What are the key properties of lanthanum;4-(methoxymethyl)-4-prop-2-enylpiperidin-1-ide?
lanthanum;4-(methoxymethyl)-4-prop-2-enylpiperidin-1-ide has a molecular weight of 307.17 g/mol, XLogP of 2.36, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for lanthanum;4-(methoxymethyl)-4-prop-2-enylpiperidin-1-ide is sourced from PubChem (CID 59312076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).