2-ethyl-4,5-dimethylidene-1H-imidazole

C7H10N2 — CID 91247008

IUPAC2-ethyl-4,5-dimethylidene-1H-imidazole
SMILESC=c1nc(CC)[nH]c1=C
InChIInChI=1S/C7H10N2/c1-4-7-8-5(2)6(3)9-7/h2-4H2,1H3,(H,8,9)
InChIKeyFRWQKKWTELCUCM-UHFFFAOYSA-N
MW122.17 g/mol
LogP-0.21
Rot. Bonds1

About 2-ethyl-4,5-dimethylidene-1H-imidazole

2-ethyl-4,5-dimethylidene-1H-imidazole (PubChem CID 91247008) has the molecular formula C7H10N2 and a molecular weight of 122.17 g/mol. Its IUPAC name is 2-ethyl-4,5-dimethylidene-1H-imidazole.

Molecular Properties

Compound Name2-ethyl-4,5-dimethylidene-1H-imidazole
PubChem CID91247008
Molecular FormulaC7H10N2
Molecular Weight122.17 g/mol
Exact Mass122.08
IUPAC Name2-ethyl-4,5-dimethylidene-1H-imidazole
SMILESC=c1nc(CC)[nH]c1=C
InChIInChI=1S/C7H10N2/c1-4-7-8-5(2)6(3)9-7/h2-4H2,1H3,(H,8,9)
InChIKeyFRWQKKWTELCUCM-UHFFFAOYSA-N
XLogP-0.21
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500122.17
LogP ≤ 5-0.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2-ethyl-4,5-dimethylidene-1H-imidazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-Methylidene-2-propan-2-yl-1,4-dihydroimidazole
CID 22093118
2-Methyl-5-methylidene-1,4-dihydroimidazole
CID 58059446
4,5-dimethanidylidene-2-methyl-1H-imidazole;yttrium
CID 59908996
2-methyl-4,5-dimethylidene-1H-imidazole
CID 59908997
(2-ethyl-4-ethylidene-1H-imidazol-5-ylidene)-methylideneazanium
CID 91232423
(4E,5E)-4-but-2-enylidene-2-ethyl-5-prop-2-enylidene-1H-imidazole
CID 91464077
(4E)-4-ethylidene-2-methyl-5-methylidene-1H-imidazole
CID 123822050
(4E,5E)-2-ethyl-4-ethylidene-5-prop-2-enylidene-1H-imidazole
CID 129019078
(4E,5E)-4,5-di(ethylidene)-2-methyl-1H-imidazole
CID 132261721
(E)-[(4E)-4-(aminomethylidene)-2-methyl-1H-imidazol-5-ylidene]methanamine
CID 139297378
2,4-dimethyl-6-methylidene-1H-pyrimidin-5-amine
CID 142610502
ethane;(4E,5E)-2-ethyl-4-ethylidene-5-prop-2-enylidene-1H-imidazole
CID 145543396

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-4,5-dimethylidene-1H-imidazole?
The IUPAC name of 2-ethyl-4,5-dimethylidene-1H-imidazole (CID 91247008) is 2-ethyl-4,5-dimethylidene-1H-imidazole.
What is the SMILES notation for 2-ethyl-4,5-dimethylidene-1H-imidazole?
The canonical SMILES for 2-ethyl-4,5-dimethylidene-1H-imidazole is C=c1nc(CC)[nH]c1=C.
What is the InChIKey of 2-ethyl-4,5-dimethylidene-1H-imidazole?
The InChIKey is FRWQKKWTELCUCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2/c1-4-7-8-5(2)6(3)9-7/h2-4H2,1H3,(H,8,9).
What are the key properties of 2-ethyl-4,5-dimethylidene-1H-imidazole?
2-ethyl-4,5-dimethylidene-1H-imidazole has a molecular weight of 122.17 g/mol, XLogP of -0.21, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-4,5-dimethylidene-1H-imidazole is sourced from PubChem (CID 91247008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).