(4E,5E)-1-methyl-4,5-di(propylidene)imidazole

C10H16N2 — CID 178116815

IUPAC(4E,5E)-1-methyl-4,5-di(propylidene)imidazole
SMILESCC/C=c1/ncn(C)/c1=C/CC
InChIInChI=1S/C10H16N2/c1-4-6-9-10(7-5-2)12(3)8-11-9/h6-8H,4-5H2,1-3H3/b9-6+,10-7+
InChIKeyMUKWHFGUWQNQGO-KZZDLZNXSA-N
MW164.25 g/mol
LogP0.80
Rot. Bonds2

About (4E,5E)-1-methyl-4,5-di(propylidene)imidazole

(4E,5E)-1-methyl-4,5-di(propylidene)imidazole (PubChem CID 178116815) has the molecular formula C10H16N2 and a molecular weight of 164.25 g/mol. Its IUPAC name is (4E,5E)-1-methyl-4,5-di(propylidene)imidazole.

Molecular Properties

Compound Name(4E,5E)-1-methyl-4,5-di(propylidene)imidazole
PubChem CID178116815
Molecular FormulaC10H16N2
Molecular Weight164.25 g/mol
Exact Mass164.13
IUPAC Name(4E,5E)-1-methyl-4,5-di(propylidene)imidazole
SMILESCC/C=c1/ncn(C)/c1=C/CC
InChIInChI=1S/C10H16N2/c1-4-6-9-10(7-5-2)12(3)8-11-9/h6-8H,4-5H2,1-3H3/b9-6+,10-7+
InChIKeyMUKWHFGUWQNQGO-KZZDLZNXSA-N
XLogP0.80
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.25
LogP ≤ 50.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(5E)-5-[(E)-2-fluoropent-2-enylidene]-1-propan-2-yl-4H-imidazole
CID 138535079
3,7-dimethyl-5H-benzimidazol-5-ide;yttrium
CID 59708940
2-[5-[Bis(dimethylamino)methylideneamino]cyclopenta-1,4-dien-1-yl]-1,1,3,3-tetramethylguanidine
CID 71037911
5-(2-Chloro-3-methylpent-2-enylidene)-1-ethyl-4-ethylideneimidazole
CID 123173232
N-[3-(5-ethylidene-3-methylimidazol-4-ylidene)prop-1-en-2-yl]-N-methylbut-2-en-2-amine
CID 123218601
N-hepta-3,5-dien-3-yl-N,N'-dimethylmethanimidamide
CID 123417471
5-Ethylidene-1-methyl-4-methylideneimidazole
CID 123678686
5-Ethylidene-1-methyl-4-pent-1-en-3-ylideneimidazole
CID 123704736
4-But-3-en-2-ylidene-5-ethylidene-1-methylimidazole
CID 123878865
5-(2-Chloro-3-methylpent-2-enylidene)-4-ethylidene-1-methylimidazole
CID 123991948
(4E,5E)-4,5-di(ethylidene)-1-methylimidazole
CID 130427202
(4E,5E)-1-methyl-4,5-bis(prop-2-enylidene)imidazole
CID 130427315

Frequently Asked Questions

What is the IUPAC name of (4E,5E)-1-methyl-4,5-di(propylidene)imidazole?
The IUPAC name of (4E,5E)-1-methyl-4,5-di(propylidene)imidazole (CID 178116815) is (4E,5E)-1-methyl-4,5-di(propylidene)imidazole.
What is the SMILES notation for (4E,5E)-1-methyl-4,5-di(propylidene)imidazole?
The canonical SMILES for (4E,5E)-1-methyl-4,5-di(propylidene)imidazole is CC/C=c1/ncn(C)/c1=C/CC.
What is the InChIKey of (4E,5E)-1-methyl-4,5-di(propylidene)imidazole?
The InChIKey is MUKWHFGUWQNQGO-KZZDLZNXSA-N. The full InChI is InChI=1S/C10H16N2/c1-4-6-9-10(7-5-2)12(3)8-11-9/h6-8H,4-5H2,1-3H3/b9-6+,10-7+.
What are the key properties of (4E,5E)-1-methyl-4,5-di(propylidene)imidazole?
(4E,5E)-1-methyl-4,5-di(propylidene)imidazole has a molecular weight of 164.25 g/mol, XLogP of 0.80, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4E,5E)-1-methyl-4,5-di(propylidene)imidazole is sourced from PubChem (CID 178116815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).