2-N-ethylidene-1-N-methylprop-2-ene-1,2-diimine

C6H10N2 — CID 123297546

IUPAC2-N-ethylidene-1-N-methylprop-2-ene-1,2-diimine
SMILESC=C(/C=N/C)/N=C/C
InChIInChI=1S/C6H10N2/c1-4-8-6(2)5-7-3/h4-5H,2H2,1,3H3/b7-5+,8-4+
InChIKeyFXPKBJZMNNCKKK-JBVHCYJISA-N
MW110.16 g/mol
LogP1.29
Rot. Bonds2

About 2-N-ethylidene-1-N-methylprop-2-ene-1,2-diimine

2-N-ethylidene-1-N-methylprop-2-ene-1,2-diimine (PubChem CID 123297546) has the molecular formula C6H10N2 and a molecular weight of 110.16 g/mol. Its IUPAC name is 2-N-ethylidene-1-N-methylprop-2-ene-1,2-diimine.

Molecular Properties

Compound Name2-N-ethylidene-1-N-methylprop-2-ene-1,2-diimine
PubChem CID123297546
Molecular FormulaC6H10N2
Molecular Weight110.16 g/mol
Exact Mass110.08
IUPAC Name2-N-ethylidene-1-N-methylprop-2-ene-1,2-diimine
SMILESC=C(/C=N/C)/N=C/C
InChIInChI=1S/C6H10N2/c1-4-8-6(2)5-7-3/h4-5H,2H2,1,3H3/b7-5+,8-4+
InChIKeyFXPKBJZMNNCKKK-JBVHCYJISA-N
XLogP1.29
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500110.16
LogP ≤ 51.29
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

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CID 76588964
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CID 118311796
2-fluoro-N-prop-1-en-2-ylprop-2-en-1-imine
CID 144380528
N-(3-fluoroprop-1-en-2-yl)ethanimine
CID 167049376
N-prop-1-en-2-ylethanimine
CID 13099162
N-prop-1-en-2-ylpropan-1-imine
CID 13099163
N-[(E)-but-2-en-2-yl]ethanimine
CID 18719779
1,5-dimethyl-2H-pyrazine
CID 20164412
N-but-2-en-2-ylethanimine
CID 20749343
N-but-2-en-2-ylpropan-1-imine
CID 21054927
Ethylidene-methyl-prop-1-en-2-ylazanium
CID 22082298

Frequently Asked Questions

What is the IUPAC name of 2-N-ethylidene-1-N-methylprop-2-ene-1,2-diimine?
The IUPAC name of 2-N-ethylidene-1-N-methylprop-2-ene-1,2-diimine (CID 123297546) is 2-N-ethylidene-1-N-methylprop-2-ene-1,2-diimine.
What is the SMILES notation for 2-N-ethylidene-1-N-methylprop-2-ene-1,2-diimine?
The canonical SMILES for 2-N-ethylidene-1-N-methylprop-2-ene-1,2-diimine is C=C(/C=N/C)/N=C/C.
What is the InChIKey of 2-N-ethylidene-1-N-methylprop-2-ene-1,2-diimine?
The InChIKey is FXPKBJZMNNCKKK-JBVHCYJISA-N. The full InChI is InChI=1S/C6H10N2/c1-4-8-6(2)5-7-3/h4-5H,2H2,1,3H3/b7-5+,8-4+.
What are the key properties of 2-N-ethylidene-1-N-methylprop-2-ene-1,2-diimine?
2-N-ethylidene-1-N-methylprop-2-ene-1,2-diimine has a molecular weight of 110.16 g/mol, XLogP of 1.29, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-ethylidene-1-N-methylprop-2-ene-1,2-diimine is sourced from PubChem (CID 123297546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).