1,2,3-trimethylimidazo[1,2-a]benzimidazole

C12H13N3 — CID 157483248

IUPAC1,2,3-trimethylimidazo[1,2-a]benzimidazole
SMILESCc1c(C)n2c3ccccc3nc2n1C
InChIInChI=1S/C12H13N3/c1-8-9(2)15-11-7-5-4-6-10(11)13-12(15)14(8)3/h4-7H,1-3H3
InChIKeyUGWUOYMNEULUBX-UHFFFAOYSA-N
MW199.26 g/mol
LogP2.44
Rot. Bonds

About 1,2,3-trimethylimidazo[1,2-a]benzimidazole

1,2,3-trimethylimidazo[1,2-a]benzimidazole (PubChem CID 157483248) has the molecular formula C12H13N3 and a molecular weight of 199.26 g/mol. Its IUPAC name is 1,2,3-trimethylimidazo[1,2-a]benzimidazole.

Molecular Properties

Compound Name1,2,3-trimethylimidazo[1,2-a]benzimidazole
PubChem CID157483248
Molecular FormulaC12H13N3
Molecular Weight199.26 g/mol
Exact Mass199.11
IUPAC Name1,2,3-trimethylimidazo[1,2-a]benzimidazole
SMILESCc1c(C)n2c3ccccc3nc2n1C
InChIInChI=1S/C12H13N3/c1-8-9(2)15-11-7-5-4-6-10(11)13-12(15)14(8)3/h4-7H,1-3H3
InChIKeyUGWUOYMNEULUBX-UHFFFAOYSA-N
XLogP2.44
TPSA22.23 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.26
LogP ≤ 52.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2,3-dimethyl-1-phenylimidazo[1,2-a]benzimidazole
CID 158748738
2-(2,3-dimethylimidazo[1,2-a]benzimidazol-1-yl)acetic acid
CID 84630754
5-methylbenzimidazolo[2,1-b]quinazolin-12-one
CID 13458566
6-methylbenzimidazolo[1,2-a]quinazolin-5-one
CID 59232444
9,23-dimethyl-9,14,21,23-tetrazahexacyclo[11.10.0.02,10.03,8.014,22.015,20]tricosa-1(13),2(10),3,5,7,11,15,17,19,21-decaene
CID 155082186
5-methyl-2-(3-methylphenyl)benzimidazolo[1,2-a]benzimidazole
CID 123753360
3,23-dimethyl-3,14,21,23-tetrazahexacyclo[11.10.0.02,10.04,9.014,22.015,20]tricosa-1(13),2(10),4,6,8,11,15,17,19,21-decaene
CID 155082006
5-(2-methylphenyl)benzimidazolo[1,2-a]benzimidazole
CID 122468410
23-methyl-9-thia-14,21,23-triazahexacyclo[11.10.0.02,10.03,8.014,22.015,20]tricosa-1(13),2(10),3,5,7,11,15,17,19,21-decaene
CID 155082026
1,2-dimethyl-3-(1-methyl-3-phenyl-2H-pyridin-1-ium-2-id-6-yl)imidazo[1,2-a]benzimidazole
CID 140932430
3-phenyl-1-(3-phenyl-[1,2,4]triazolo[4,3-a]benzimidazol-1-yl)-[1,2,4]triazolo[4,3-a]benzimidazole
CID 11236662
13-(3,5-dimethylphenyl)-1,3,10,16,23-pentazaheptacyclo[13.9.1.02,10.04,9.011,25.016,24.017,22]pentacosa-2,4,6,8,11,13,15(25),17,19,21,23-undecaene
CID 146652312

Frequently Asked Questions

What is the IUPAC name of 1,2,3-trimethylimidazo[1,2-a]benzimidazole?
The IUPAC name of 1,2,3-trimethylimidazo[1,2-a]benzimidazole (CID 157483248) is 1,2,3-trimethylimidazo[1,2-a]benzimidazole.
What is the SMILES notation for 1,2,3-trimethylimidazo[1,2-a]benzimidazole?
The canonical SMILES for 1,2,3-trimethylimidazo[1,2-a]benzimidazole is Cc1c(C)n2c3ccccc3nc2n1C.
What is the InChIKey of 1,2,3-trimethylimidazo[1,2-a]benzimidazole?
The InChIKey is UGWUOYMNEULUBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13N3/c1-8-9(2)15-11-7-5-4-6-10(11)13-12(15)14(8)3/h4-7H,1-3H3.
What are the key properties of 1,2,3-trimethylimidazo[1,2-a]benzimidazole?
1,2,3-trimethylimidazo[1,2-a]benzimidazole has a molecular weight of 199.26 g/mol, XLogP of 2.44, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,3-trimethylimidazo[1,2-a]benzimidazole is sourced from PubChem (CID 157483248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).