1-ethyl-5-ethylidene-2-methyl-4H-imidazole

C8H14N2 — CID 123973005

IUPAC1-ethyl-5-ethylidene-2-methyl-4H-imidazole
SMILESCC=C1CN=C(C)N1CC
InChIInChI=1S/C8H14N2/c1-4-8-6-9-7(3)10(8)5-2/h4H,5-6H2,1-3H3
InChIKeyXOIFZIVWBSLXLW-UHFFFAOYSA-N
MW138.21 g/mol
LogP1.64
Rot. Bonds1

About 1-ethyl-5-ethylidene-2-methyl-4H-imidazole

1-ethyl-5-ethylidene-2-methyl-4H-imidazole (PubChem CID 123973005) has the molecular formula C8H14N2 and a molecular weight of 138.21 g/mol. Its IUPAC name is 1-ethyl-5-ethylidene-2-methyl-4H-imidazole.

Molecular Properties

Compound Name1-ethyl-5-ethylidene-2-methyl-4H-imidazole
PubChem CID123973005
Molecular FormulaC8H14N2
Molecular Weight138.21 g/mol
Exact Mass138.12
IUPAC Name1-ethyl-5-ethylidene-2-methyl-4H-imidazole
SMILESCC=C1CN=C(C)N1CC
InChIInChI=1S/C8H14N2/c1-4-8-6-9-7(3)10(8)5-2/h4H,5-6H2,1-3H3
InChIKeyXOIFZIVWBSLXLW-UHFFFAOYSA-N
XLogP1.64
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.21
LogP ≤ 51.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(Z,4E)-4-(2,3-dimethyl-4H-imidazol-5-ylidene)-1,1,1-trifluorobut-2-en-2-yl]methanimine
CID 137468195
Dimethylbenzimidazole cobalt chloride
CID 129704091
1-[(E)-but-2-en-2-yl]-4,5-dihydroimidazole
CID 23175353
Diethyl-(1-methyl-5-methylidenepyrrol-2-ylidene)azanium
CID 23558529
1,2-dimethyl-5-methylidene-4H-imidazole
CID 53868890
1,2,4-trimethyl-5-methylidene-4H-imidazole
CID 54449972
2-Methyl-1-phenyl-4,5-dihydroimidazole;tungsten
CID 58914513
1,2-dimethyl-4H-benzimidazol-4-ide;yttrium
CID 59890588
1,2,3,6-tetramethyl-4H-pyrimidin-3-ium
CID 66739432
2-ethyl-1-methyl-5-methylidene-4H-imidazole
CID 67476715
3-tert-butyl-2,6-dimethyl-4H-pyrimidine
CID 67682841
1-Ethenyl-2-prop-1-enyl-4,5-dihydroimidazole
CID 67789097

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-5-ethylidene-2-methyl-4H-imidazole?
The IUPAC name of 1-ethyl-5-ethylidene-2-methyl-4H-imidazole (CID 123973005) is 1-ethyl-5-ethylidene-2-methyl-4H-imidazole.
What is the SMILES notation for 1-ethyl-5-ethylidene-2-methyl-4H-imidazole?
The canonical SMILES for 1-ethyl-5-ethylidene-2-methyl-4H-imidazole is CC=C1CN=C(C)N1CC.
What is the InChIKey of 1-ethyl-5-ethylidene-2-methyl-4H-imidazole?
The InChIKey is XOIFZIVWBSLXLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2/c1-4-8-6-9-7(3)10(8)5-2/h4H,5-6H2,1-3H3.
What are the key properties of 1-ethyl-5-ethylidene-2-methyl-4H-imidazole?
1-ethyl-5-ethylidene-2-methyl-4H-imidazole has a molecular weight of 138.21 g/mol, XLogP of 1.64, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-5-ethylidene-2-methyl-4H-imidazole is sourced from PubChem (CID 123973005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).