2-ethenyl-6,7-dimethyl-1-[(Z)-prop-1-enyl]-4H-imidazo[1,2-a]benzimidazole

C16H17N3 — CID 145008593

IUPAC2-ethenyl-6,7-dimethyl-1-[(Z)-prop-1-enyl]-4H-imidazo[1,2-a]benzimidazole
SMILESC=Cc1nc2[nH]c3cc(C)c(C)cc3n2c1/C=C\C
InChIInChI=1S/C16H17N3/c1-5-7-14-12(6-2)17-16-18-13-8-10(3)11(4)9-15(13)19(14)16/h5-9H,2H2,1,3-4H3,(H,17,18)/b7-5-
InChIKeyCWEPSCLBJRXLHJ-ALCCZGGFSA-N
MW251.33 g/mol
LogP4.11
Rot. Bonds2

About 2-ethenyl-6,7-dimethyl-1-[(Z)-prop-1-enyl]-4H-imidazo[1,2-a]benzimidazole

2-ethenyl-6,7-dimethyl-1-[(Z)-prop-1-enyl]-4H-imidazo[1,2-a]benzimidazole (PubChem CID 145008593) has the molecular formula C16H17N3 and a molecular weight of 251.33 g/mol. Its IUPAC name is 2-ethenyl-6,7-dimethyl-1-[(Z)-prop-1-enyl]-4H-imidazo[1,2-a]benzimidazole.

Molecular Properties

Compound Name2-ethenyl-6,7-dimethyl-1-[(Z)-prop-1-enyl]-4H-imidazo[1,2-a]benzimidazole
PubChem CID145008593
Molecular FormulaC16H17N3
Molecular Weight251.33 g/mol
Exact Mass251.14
IUPAC Name2-ethenyl-6,7-dimethyl-1-[(Z)-prop-1-enyl]-4H-imidazo[1,2-a]benzimidazole
SMILESC=Cc1nc2[nH]c3cc(C)c(C)cc3n2c1/C=C\C
InChIInChI=1S/C16H17N3/c1-5-7-14-12(6-2)17-16-18-13-8-10(3)11(4)9-15(13)19(14)16/h5-9H,2H2,1,3-4H3,(H,17,18)/b7-5-
InChIKeyCWEPSCLBJRXLHJ-ALCCZGGFSA-N
XLogP4.11
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.33
LogP ≤ 54.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-ethenyl-6,7-dimethyl-1-[(Z)-prop-1-enyl]-4H-imidazo[1,2-a]benzimidazole 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-chloro-1-ethenyl-2-[(Z)-prop-1-enyl]-3H-imidazo[1,2-a]benzimidazole
CID 145283610
2,6-bis(ethenyl)-3,7-dimethyl-5-prop-1-enylimidazo[1,2-a]imidazole
CID 123943677
2-[4,5-bis[(E)-prop-1-enyl]-1H-imidazol-2-yl]-5,6-dimethyl-1H-benzimidazole
CID 143872685
8-ethenyl-9-[(Z)-prop-1-enyl]-7,10,21,28-tetrazadecacyclo[17.13.2.22,5.03,15.04,12.06,10.016,33.020,28.022,27.030,34]hexatriaconta-1(32),2,4,6,8,12,14,16(33),17,19(34),20,22,24,26,30,35-hexadecaene-11,29-dione
CID 143070962
CID 171502669
CID 171502669
1-ethenyl-4-methyl-2-[(Z)-prop-1-enyl]imidazo[1,2-a]benzimidazole
CID 134457642
6-ethenyl-2-prop-1-enyl-1H-benzimidazole
CID 67635738
6-ethenyl-2-[(Z)-prop-1-enyl]-1H-benzimidazole
CID 67635734
[4-ethenyl-5-[(Z)-prop-1-enyl]-1H-imidazol-2-yl]methanamine
CID 142260701
3-ethenyl-1,5-dimethyl-2-[(Z)-prop-1-enyl]indole
CID 144680666
ethane;4-ethenyl-2-methyl-5-[(Z)-prop-1-enyl]-1,3-oxazole
CID 142166033
ethane;6-ethenyl-3-methyl-5-[(Z)-prop-1-enyl]-1H-pyrazine-2-thione
CID 145341104

Frequently Asked Questions

What is the IUPAC name of 2-ethenyl-6,7-dimethyl-1-[(Z)-prop-1-enyl]-4H-imidazo[1,2-a]benzimidazole?
The IUPAC name of 2-ethenyl-6,7-dimethyl-1-[(Z)-prop-1-enyl]-4H-imidazo[1,2-a]benzimidazole (CID 145008593) is 2-ethenyl-6,7-dimethyl-1-[(Z)-prop-1-enyl]-4H-imidazo[1,2-a]benzimidazole.
What is the SMILES notation for 2-ethenyl-6,7-dimethyl-1-[(Z)-prop-1-enyl]-4H-imidazo[1,2-a]benzimidazole?
The canonical SMILES for 2-ethenyl-6,7-dimethyl-1-[(Z)-prop-1-enyl]-4H-imidazo[1,2-a]benzimidazole is C=Cc1nc2[nH]c3cc(C)c(C)cc3n2c1/C=C\C.
What is the InChIKey of 2-ethenyl-6,7-dimethyl-1-[(Z)-prop-1-enyl]-4H-imidazo[1,2-a]benzimidazole?
The InChIKey is CWEPSCLBJRXLHJ-ALCCZGGFSA-N. The full InChI is InChI=1S/C16H17N3/c1-5-7-14-12(6-2)17-16-18-13-8-10(3)11(4)9-15(13)19(14)16/h5-9H,2H2,1,3-4H3,(H,17,18)/b7-5-.
What are the key properties of 2-ethenyl-6,7-dimethyl-1-[(Z)-prop-1-enyl]-4H-imidazo[1,2-a]benzimidazole?
2-ethenyl-6,7-dimethyl-1-[(Z)-prop-1-enyl]-4H-imidazo[1,2-a]benzimidazole has a molecular weight of 251.33 g/mol, XLogP of 4.11, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethenyl-6,7-dimethyl-1-[(Z)-prop-1-enyl]-4H-imidazo[1,2-a]benzimidazole is sourced from PubChem (CID 145008593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).