ethane;2-methylideneimidazole

C6H10N2 — CID 90779285

IUPACethane;2-methylideneimidazole
SMILESC=C1N=CC=N1.CC
InChIInChI=1S/C4H4N2.C2H6/c1-4-5-2-3-6-4;1-2/h2-3H,1H2;1-2H3
InChIKeyJOXRJKAFTMQAOV-UHFFFAOYSA-N
MW110.16 g/mol
LogP1.64
Rot. Bonds

About ethane;2-methylideneimidazole

ethane;2-methylideneimidazole (PubChem CID 90779285) has the molecular formula C6H10N2 and a molecular weight of 110.16 g/mol. Its IUPAC name is ethane;2-methylideneimidazole.

Molecular Properties

Compound Nameethane;2-methylideneimidazole
PubChem CID90779285
Molecular FormulaC6H10N2
Molecular Weight110.16 g/mol
Exact Mass110.08
IUPAC Nameethane;2-methylideneimidazole
SMILESC=C1N=CC=N1.CC
InChIInChI=1S/C4H4N2.C2H6/c1-4-5-2-3-6-4;1-2/h2-3H,1H2;1-2H3
InChIKeyJOXRJKAFTMQAOV-UHFFFAOYSA-N
XLogP1.64
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500110.16
LogP ≤ 51.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

6-Dimethylamino-2,5-diazafulvene
CID 10396839
Methylene-imidazole
CID 21951823
2-N'-ethylidene-1-N-methyl-2-N-methylideneethene-1,2,2-triimine
CID 53843184
2-Ethylideneimidazole
CID 56993510
3-methyl-2-methylidene-4H-imidazole
CID 67978385
N-[(Z)-2-(ethylideneamino)ethenyl]ethanimine
CID 88583063
N-[1-(methylideneamino)ethenyl]ethanimine
CID 90690774
N-[1-(methylideneamino)ethenyl]butan-1-imine
CID 90810945
ethane;2H-imidazole
CID 91020013
N-[1-(methylideneamino)ethenyl]propan-1-imine
CID 91042440
N-[1-(methylideneamino)prop-1-enyl]ethanimine
CID 91297018
ethane;2-methyl-2H-imidazole
CID 91391426

Frequently Asked Questions

What is the IUPAC name of ethane;2-methylideneimidazole?
The IUPAC name of ethane;2-methylideneimidazole (CID 90779285) is ethane;2-methylideneimidazole.
What is the SMILES notation for ethane;2-methylideneimidazole?
The canonical SMILES for ethane;2-methylideneimidazole is C=C1N=CC=N1.CC.
What is the InChIKey of ethane;2-methylideneimidazole?
The InChIKey is JOXRJKAFTMQAOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H4N2.C2H6/c1-4-5-2-3-6-4;1-2/h2-3H,1H2;1-2H3.
What are the key properties of ethane;2-methylideneimidazole?
ethane;2-methylideneimidazole has a molecular weight of 110.16 g/mol, XLogP of 1.64, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;2-methylideneimidazole is sourced from PubChem (CID 90779285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).