(Z)-N-(5-ethenyl-1,3-dioxol-4-yl)ethanimine

C7H9NO2 — CID 145064608

IUPAC(Z)-N-(5-ethenyl-1,3-dioxol-4-yl)ethanimine
SMILESC=CC1=C(/N=C\C)OCO1
InChIInChI=1S/C7H9NO2/c1-3-6-7(8-4-2)10-5-9-6/h3-4H,1,5H2,2H3/b8-4-
InChIKeyRCUQTZUUOIGODA-YWEYNIOJSA-N
MW139.15 g/mol
LogP1.44
Rot. Bonds2

About (Z)-N-(5-ethenyl-1,3-dioxol-4-yl)ethanimine

(Z)-N-(5-ethenyl-1,3-dioxol-4-yl)ethanimine (PubChem CID 145064608) has the molecular formula C7H9NO2 and a molecular weight of 139.15 g/mol. Its IUPAC name is (Z)-N-(5-ethenyl-1,3-dioxol-4-yl)ethanimine.

Molecular Properties

Compound Name(Z)-N-(5-ethenyl-1,3-dioxol-4-yl)ethanimine
PubChem CID145064608
Molecular FormulaC7H9NO2
Molecular Weight139.15 g/mol
Exact Mass139.06
IUPAC Name(Z)-N-(5-ethenyl-1,3-dioxol-4-yl)ethanimine
SMILESC=CC1=C(/N=C\C)OCO1
InChIInChI=1S/C7H9NO2/c1-3-6-7(8-4-2)10-5-9-6/h3-4H,1,5H2,2H3/b8-4-
InChIKeyRCUQTZUUOIGODA-YWEYNIOJSA-N
XLogP1.44
TPSA30.82 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.15
LogP ≤ 51.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

4-ethenyl-5-[(E)-3-methylbut-1-enyl]-1,3-dioxole
CID 139322701
2,3-bis(ethenyl)-6,7-dihydro-5H-1,4-dioxepine;ethane
CID 168899023
5,6-bis(ethenyl)-2-methyl-2,3-dihydro-1,4-dioxine
CID 142091973
ethane;N-(5-ethenyl-2,3-dihydro-1H-pyrrol-4-yl)ethanimine
CID 142623943
(4E,5E)-4,5-di(ethylidene)-1,3-dioxolane;methanamine;prop-1-ene
CID 160974653
2,3-bis(ethenyl)-6,6-dimethyl-5,7-dihydro-1,4-dioxepine
CID 156792165
N-(6-ethenylcyclohexa-1,5-dien-1-yl)ethanimine
CID 152858957
6-ethenyl-3-methyl-5-[(Z)-prop-1-enyl]-2,3-dihydropyran-4-one
CID 155711315
6-ethenyl-5-[(Z)-prop-1-enyl]-3,4-dihydro-2H-pyran
CID 70273510
4,5-bis(ethenyl)-2-methyl-2,3-dihydrofuran;ethane
CID 144691925
1-[5,6-bis(ethenyl)-3,4-dihydro-2H-1,4-oxazin-3-yl]-2-methylpropan-1-one;ethane
CID 163241818
5,6-bis(ethenyl)-4-propan-2-yl-3,4-dihydro-2H-pyran
CID 156791141

Frequently Asked Questions

What is the IUPAC name of (Z)-N-(5-ethenyl-1,3-dioxol-4-yl)ethanimine?
The IUPAC name of (Z)-N-(5-ethenyl-1,3-dioxol-4-yl)ethanimine (CID 145064608) is (Z)-N-(5-ethenyl-1,3-dioxol-4-yl)ethanimine.
What is the SMILES notation for (Z)-N-(5-ethenyl-1,3-dioxol-4-yl)ethanimine?
The canonical SMILES for (Z)-N-(5-ethenyl-1,3-dioxol-4-yl)ethanimine is C=CC1=C(/N=C\C)OCO1.
What is the InChIKey of (Z)-N-(5-ethenyl-1,3-dioxol-4-yl)ethanimine?
The InChIKey is RCUQTZUUOIGODA-YWEYNIOJSA-N. The full InChI is InChI=1S/C7H9NO2/c1-3-6-7(8-4-2)10-5-9-6/h3-4H,1,5H2,2H3/b8-4-.
What are the key properties of (Z)-N-(5-ethenyl-1,3-dioxol-4-yl)ethanimine?
(Z)-N-(5-ethenyl-1,3-dioxol-4-yl)ethanimine has a molecular weight of 139.15 g/mol, XLogP of 1.44, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-(5-ethenyl-1,3-dioxol-4-yl)ethanimine is sourced from PubChem (CID 145064608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).