5-ethylidene-2-methyl-4-methylidene-1-propan-2-ylimidazole

C10H16N2 — CID 90894415

IUPAC5-ethylidene-2-methyl-4-methylidene-1-propan-2-ylimidazole
SMILESC=c1nc(C)n(C(C)C)c1=CC
InChIInChI=1S/C10H16N2/c1-6-10-8(4)11-9(5)12(10)7(2)3/h6-7H,4H2,1-3,5H3
InChIKeyRBRUJTMAQSTXCM-UHFFFAOYSA-N
MW164.25 g/mol
LogP0.98
Rot. Bonds1

About 5-ethylidene-2-methyl-4-methylidene-1-propan-2-ylimidazole

5-ethylidene-2-methyl-4-methylidene-1-propan-2-ylimidazole (PubChem CID 90894415) has the molecular formula C10H16N2 and a molecular weight of 164.25 g/mol. Its IUPAC name is 5-ethylidene-2-methyl-4-methylidene-1-propan-2-ylimidazole.

Molecular Properties

Compound Name5-ethylidene-2-methyl-4-methylidene-1-propan-2-ylimidazole
PubChem CID90894415
Molecular FormulaC10H16N2
Molecular Weight164.25 g/mol
Exact Mass164.13
IUPAC Name5-ethylidene-2-methyl-4-methylidene-1-propan-2-ylimidazole
SMILESC=c1nc(C)n(C(C)C)c1=CC
InChIInChI=1S/C10H16N2/c1-6-10-8(4)11-9(5)12(10)7(2)3/h6-7H,4H2,1-3,5H3
InChIKeyRBRUJTMAQSTXCM-UHFFFAOYSA-N
XLogP0.98
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.25
LogP ≤ 50.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(4Z,5E)-4-(1-fluoroethylidene)-2-methyl-1-propan-2-yl-5-propylideneimidazole
CID 135162214
Diethyl-(1-methyl-5-methylidenepyrrol-2-ylidene)azanium
CID 23558529
2-Methyl-1-phenyl-4,5-dihydroimidazole;tungsten
CID 58914513
2,5-Dimethyl-2,3-dihydroimidazo[1,2-a]pyridine
CID 89344976
(2R)-2,5-dimethyl-2,3-dihydroimidazo[1,2-a]pyridine
CID 89703925
N-[3-(5-ethylidene-3-methylimidazol-4-ylidene)prop-1-en-2-yl]-N-methylbut-2-en-2-amine
CID 123218601
N-ethyl-N'-methyl-N-penta-1,3-dien-2-ylethanimidamide
CID 123888014
1-ethyl-5-ethylidene-2-methyl-4H-imidazole
CID 123973005
(E,4E)-N,N-dimethyl-4-(2-methyl-5-methylidene-1H-imidazol-4-ylidene)but-2-en-2-amine
CID 134299445
1,2-Dimethyl-4,5-dimethylideneimidazole
CID 135128795
(4E,5E)-5-ethylidene-2-methyl-4-(2-methylpropylidene)-1-propan-2-ylimidazole
CID 135162548
ethane;1-ethyl-2-methyl-5-methylidene-4H-imidazole
CID 141822302

Frequently Asked Questions

What is the IUPAC name of 5-ethylidene-2-methyl-4-methylidene-1-propan-2-ylimidazole?
The IUPAC name of 5-ethylidene-2-methyl-4-methylidene-1-propan-2-ylimidazole (CID 90894415) is 5-ethylidene-2-methyl-4-methylidene-1-propan-2-ylimidazole.
What is the SMILES notation for 5-ethylidene-2-methyl-4-methylidene-1-propan-2-ylimidazole?
The canonical SMILES for 5-ethylidene-2-methyl-4-methylidene-1-propan-2-ylimidazole is C=c1nc(C)n(C(C)C)c1=CC.
What is the InChIKey of 5-ethylidene-2-methyl-4-methylidene-1-propan-2-ylimidazole?
The InChIKey is RBRUJTMAQSTXCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2/c1-6-10-8(4)11-9(5)12(10)7(2)3/h6-7H,4H2,1-3,5H3.
What are the key properties of 5-ethylidene-2-methyl-4-methylidene-1-propan-2-ylimidazole?
5-ethylidene-2-methyl-4-methylidene-1-propan-2-ylimidazole has a molecular weight of 164.25 g/mol, XLogP of 0.98, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethylidene-2-methyl-4-methylidene-1-propan-2-ylimidazole is sourced from PubChem (CID 90894415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).