4-(methoxymethyl)-4-prop-2-enylpiperidine

C10H19NO — CID 59312077

IUPAC4-(methoxymethyl)-4-prop-2-enylpiperidine
SMILESC=CCC1(COC)CCNCC1
InChIInChI=1S/C10H19NO/c1-3-4-10(9-12-2)5-7-11-8-6-10/h3,11H,1,4-9H2,2H3
InChIKeyDPMVDQVCLSZSGF-UHFFFAOYSA-N
MW169.27 g/mol
LogP1.58
Rot. Bonds4

About 4-(methoxymethyl)-4-prop-2-enylpiperidine

4-(methoxymethyl)-4-prop-2-enylpiperidine (PubChem CID 59312077) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is 4-(methoxymethyl)-4-prop-2-enylpiperidine.

Molecular Properties

Compound Name4-(methoxymethyl)-4-prop-2-enylpiperidine
PubChem CID59312077
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name4-(methoxymethyl)-4-prop-2-enylpiperidine
SMILESC=CCC1(COC)CCNCC1
InChIInChI=1S/C10H19NO/c1-3-4-10(9-12-2)5-7-11-8-6-10/h3,11H,1,4-9H2,2H3
InChIKeyDPMVDQVCLSZSGF-UHFFFAOYSA-N
XLogP1.58
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 51.58
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

Lanthanum;4-(methoxymethyl)-4-prop-2-enylpiperidin-1-ide
CID 59312076
4-((Allyloxy)methyl)-4-methylpiperidine
CID 86710837
4-(1-Ethoxyethenyl)piperidine
CID 89209600
2-Ethoxy-6-azaspiro[2.5]oct-1-ene
CID 138480201
2-ethyl-N-(1-methoxyethyl)-2-methylpent-4-en-1-amine
CID 139312912
4-Methyl-4-(prop-2-enoxymethyl)piperidine;hydrochloride
CID 140276409
N-[3-(piperidin-4-ylmethoxy)propyl]but-3-en-1-amine
CID 141050459
2-Oxa-8-azaspiro[4.5]dec-3-ene
CID 141701201
ethane;1-ethenoxy-1-(4-ethylpiperidin-4-yl)-N-methylmethanamine;prop-1-ene
CID 144056593
2-Oxa-7-azaspiro[3.5]nonane;prop-1-ene
CID 144251190
4-(Ethenoxymethyl)-4-methylpiperidine;2-methylidenebut-3-en-1-amine
CID 144547117
4-(Ethenoxymethyl)-4-ethenylpiperidine;prop-2-en-1-amine
CID 144547629

Frequently Asked Questions

What is the IUPAC name of 4-(methoxymethyl)-4-prop-2-enylpiperidine?
The IUPAC name of 4-(methoxymethyl)-4-prop-2-enylpiperidine (CID 59312077) is 4-(methoxymethyl)-4-prop-2-enylpiperidine.
What is the SMILES notation for 4-(methoxymethyl)-4-prop-2-enylpiperidine?
The canonical SMILES for 4-(methoxymethyl)-4-prop-2-enylpiperidine is C=CCC1(COC)CCNCC1.
What is the InChIKey of 4-(methoxymethyl)-4-prop-2-enylpiperidine?
The InChIKey is DPMVDQVCLSZSGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO/c1-3-4-10(9-12-2)5-7-11-8-6-10/h3,11H,1,4-9H2,2H3.
What are the key properties of 4-(methoxymethyl)-4-prop-2-enylpiperidine?
4-(methoxymethyl)-4-prop-2-enylpiperidine has a molecular weight of 169.27 g/mol, XLogP of 1.58, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(methoxymethyl)-4-prop-2-enylpiperidine is sourced from PubChem (CID 59312077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).