ethane;N-[(Z)-2-(methylideneamino)ethenyl]ethanimine

C7H14N2 — CID 142047011

IUPACethane;N-[(Z)-2-(methylideneamino)ethenyl]ethanimine
SMILESC=N/C=C\N=C\C.CC
InChIInChI=1S/C5H8N2.C2H6/c1-3-7-5-4-6-2;1-2/h3-5H,2H2,1H3;1-2H3/b5-4-,7-3+;
InChIKeyODLXPUHHMQCSDI-GJJHOYHHSA-N
MW126.20 g/mol
LogP2.28
Rot. Bonds2

About ethane;N-[(Z)-2-(methylideneamino)ethenyl]ethanimine

ethane;N-[(Z)-2-(methylideneamino)ethenyl]ethanimine (PubChem CID 142047011) has the molecular formula C7H14N2 and a molecular weight of 126.20 g/mol. Its IUPAC name is ethane;N-[(Z)-2-(methylideneamino)ethenyl]ethanimine.

Molecular Properties

Compound Nameethane;N-[(Z)-2-(methylideneamino)ethenyl]ethanimine
PubChem CID142047011
Molecular FormulaC7H14N2
Molecular Weight126.20 g/mol
Exact Mass126.12
IUPAC Nameethane;N-[(Z)-2-(methylideneamino)ethenyl]ethanimine
SMILESC=N/C=C\N=C\C.CC
InChIInChI=1S/C5H8N2.C2H6/c1-3-7-5-4-6-2;1-2/h3-5H,2H2,1H3;1-2H3/b5-4-,7-3+;
InChIKeyODLXPUHHMQCSDI-GJJHOYHHSA-N
XLogP2.28
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.20
LogP ≤ 52.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-[(Z)-prop-1-enyl]ethanimine
CID 59954783
ethane;propane;N-[(Z)-prop-1-enyl]methanimine
CID 178138060
(3Z)-4-(ethylideneamino)buta-1,3-dien-2-ol
CID 143328048
ethane;N-[(1Z,3Z)-3-methylpenta-1,3-dienyl]ethanimine
CID 142064369
buta-1,3-diene;ethane;N-ethenylethanimine
CID 142052316
N-[(1Z)-buta-1,3-dienyl]methanimine;ethane
CID 90844285
N-[(1Z)-penta-1,3-dienyl]ethanimine
CID 91245068
N-(3-chlorobuta-1,3-dienyl)ethanimine
CID 123742417
(Z)-N-ethenyl-N'-ethylideneprop-2-ene-1,3-diimine
CID 126660383
ethane;N-[(1Z,3Z)-5-methylhexa-1,3-dienyl]methanimine
CID 143010225
ethane;N-ethenylethanimine;propane
CID 143338829
N-[(E)-but-1-enyl]ethanimine
CID 147915693

Frequently Asked Questions

What is the IUPAC name of ethane;N-[(Z)-2-(methylideneamino)ethenyl]ethanimine?
The IUPAC name of ethane;N-[(Z)-2-(methylideneamino)ethenyl]ethanimine (CID 142047011) is ethane;N-[(Z)-2-(methylideneamino)ethenyl]ethanimine.
What is the SMILES notation for ethane;N-[(Z)-2-(methylideneamino)ethenyl]ethanimine?
The canonical SMILES for ethane;N-[(Z)-2-(methylideneamino)ethenyl]ethanimine is C=N/C=C\N=C\C.CC.
What is the InChIKey of ethane;N-[(Z)-2-(methylideneamino)ethenyl]ethanimine?
The InChIKey is ODLXPUHHMQCSDI-GJJHOYHHSA-N. The full InChI is InChI=1S/C5H8N2.C2H6/c1-3-7-5-4-6-2;1-2/h3-5H,2H2,1H3;1-2H3/b5-4-,7-3+;.
What are the key properties of ethane;N-[(Z)-2-(methylideneamino)ethenyl]ethanimine?
ethane;N-[(Z)-2-(methylideneamino)ethenyl]ethanimine has a molecular weight of 126.20 g/mol, XLogP of 2.28, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N-[(Z)-2-(methylideneamino)ethenyl]ethanimine is sourced from PubChem (CID 142047011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).