ethane;(4E,5E)-1-methyl-4,5-bis(prop-2-enylidene)imidazole

C14H24N2 — CID 143678848

IUPACethane;(4E,5E)-1-methyl-4,5-bis(prop-2-enylidene)imidazole
SMILESC=C/C=c1/ncn(C)/c1=C/C=C.CC.CC
InChIInChI=1S/C10H12N2.2C2H6/c1-4-6-9-10(7-5-2)12(3)8-11-9;2*1-2/h4-8H,1-2H2,3H3;2*1-2H3/b9-6+,10-7+;;
InChIKeyZOZDPCCSBPGVHT-OUFZTKPXSA-N
MW220.36 g/mol
LogP2.41
Rot. Bonds2

About ethane;(4E,5E)-1-methyl-4,5-bis(prop-2-enylidene)imidazole

ethane;(4E,5E)-1-methyl-4,5-bis(prop-2-enylidene)imidazole (PubChem CID 143678848) has the molecular formula C14H24N2 and a molecular weight of 220.36 g/mol. Its IUPAC name is ethane;(4E,5E)-1-methyl-4,5-bis(prop-2-enylidene)imidazole.

Molecular Properties

Compound Nameethane;(4E,5E)-1-methyl-4,5-bis(prop-2-enylidene)imidazole
PubChem CID143678848
Molecular FormulaC14H24N2
Molecular Weight220.36 g/mol
Exact Mass220.19
IUPAC Nameethane;(4E,5E)-1-methyl-4,5-bis(prop-2-enylidene)imidazole
SMILESC=C/C=c1/ncn(C)/c1=C/C=C.CC.CC
InChIInChI=1S/C10H12N2.2C2H6/c1-4-6-9-10(7-5-2)12(3)8-11-9;2*1-2/h4-8H,1-2H2,3H3;2*1-2H3/b9-6+,10-7+;;
InChIKeyZOZDPCCSBPGVHT-OUFZTKPXSA-N
XLogP2.41
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.36
LogP ≤ 52.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-Ethyl-5-(1-fluoroprop-2-enylidene)-4-methylideneimidazole
CID 124012782
(5E)-5-[(2E)-2-fluoropenta-2,4-dienylidene]-4H-imidazole-3-carbonitrile
CID 138535077
(Phenylazanidylmethylideneamino)methylidenetungsten;propane;vanadium(2+)
CID 20752938
N,N-dimethyl-N'-(phenyliminomethyl)methanimidamide;tungsten(2+)
CID 21019641
1-methyl-4H-benzimidazol-4-ide;yttrium
CID 59098102
(5Z,7Z)-3-methyl-9-methylidene-4H-1,3-diazonine
CID 68215782
(4E)-4-[(Z)-but-2-enylidene]-5-methylidene-1H-imidazole
CID 88244269
N-methyl-1-(2-methylidene-1-pyridinyl)methanimine
CID 89288883
N-[3-(5-ethylidene-3-methylimidazol-4-ylidene)prop-1-en-2-yl]-N-methylbut-2-en-2-amine
CID 123218601
N-butan-2-yl-1-(2-methylidene-1-pyridinyl)methanimine
CID 123279872
4-Ethenylidene-1-methyl-5-(3-methylbut-2-enylidene)imidazole
CID 123437116
(4E,5E)-4-ethylidene-5-prop-2-enylidene-1H-imidazole
CID 123668500

Frequently Asked Questions

What is the IUPAC name of ethane;(4E,5E)-1-methyl-4,5-bis(prop-2-enylidene)imidazole?
The IUPAC name of ethane;(4E,5E)-1-methyl-4,5-bis(prop-2-enylidene)imidazole (CID 143678848) is ethane;(4E,5E)-1-methyl-4,5-bis(prop-2-enylidene)imidazole.
What is the SMILES notation for ethane;(4E,5E)-1-methyl-4,5-bis(prop-2-enylidene)imidazole?
The canonical SMILES for ethane;(4E,5E)-1-methyl-4,5-bis(prop-2-enylidene)imidazole is C=C/C=c1/ncn(C)/c1=C/C=C.CC.CC.
What is the InChIKey of ethane;(4E,5E)-1-methyl-4,5-bis(prop-2-enylidene)imidazole?
The InChIKey is ZOZDPCCSBPGVHT-OUFZTKPXSA-N. The full InChI is InChI=1S/C10H12N2.2C2H6/c1-4-6-9-10(7-5-2)12(3)8-11-9;2*1-2/h4-8H,1-2H2,3H3;2*1-2H3/b9-6+,10-7+;;.
What are the key properties of ethane;(4E,5E)-1-methyl-4,5-bis(prop-2-enylidene)imidazole?
ethane;(4E,5E)-1-methyl-4,5-bis(prop-2-enylidene)imidazole has a molecular weight of 220.36 g/mol, XLogP of 2.41, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;(4E,5E)-1-methyl-4,5-bis(prop-2-enylidene)imidazole is sourced from PubChem (CID 143678848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).