2,3-dimethyl-1-phenylimidazo[1,2-a]benzimidazole

C17H15N3 — CID 158748738

IUPAC2,3-dimethyl-1-phenylimidazo[1,2-a]benzimidazole
SMILESCc1c(-c2ccccc2)n2c3ccccc3nc2n1C
InChIInChI=1S/C17H15N3/c1-12-16(13-8-4-3-5-9-13)20-15-11-7-6-10-14(15)18-17(20)19(12)2/h3-11H,1-2H3
InChIKeyVRZCZQBUKLEDKP-UHFFFAOYSA-N
MW261.33 g/mol
LogP3.80
Rot. Bonds1

About 2,3-dimethyl-1-phenylimidazo[1,2-a]benzimidazole

2,3-dimethyl-1-phenylimidazo[1,2-a]benzimidazole (PubChem CID 158748738) has the molecular formula C17H15N3 and a molecular weight of 261.33 g/mol. Its IUPAC name is 2,3-dimethyl-1-phenylimidazo[1,2-a]benzimidazole.

Molecular Properties

Compound Name2,3-dimethyl-1-phenylimidazo[1,2-a]benzimidazole
PubChem CID158748738
Molecular FormulaC17H15N3
Molecular Weight261.33 g/mol
Exact Mass261.13
IUPAC Name2,3-dimethyl-1-phenylimidazo[1,2-a]benzimidazole
SMILESCc1c(-c2ccccc2)n2c3ccccc3nc2n1C
InChIInChI=1S/C17H15N3/c1-12-16(13-8-4-3-5-9-13)20-15-11-7-6-10-14(15)18-17(20)19(12)2/h3-11H,1-2H3
InChIKeyVRZCZQBUKLEDKP-UHFFFAOYSA-N
XLogP3.80
TPSA22.23 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.33
LogP ≤ 53.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1,2,3-trimethylimidazo[1,2-a]benzimidazole
CID 157483248
2-(2,3-dimethylimidazo[1,2-a]benzimidazol-1-yl)acetic acid
CID 84630754
6-methylbenzimidazolo[1,2-a]quinazolin-5-one
CID 59232444
5-methylbenzimidazolo[2,1-b]quinazolin-12-one
CID 13458566
5-methyl-2-(3-methylphenyl)benzimidazolo[1,2-a]benzimidazole
CID 123753360
14-methyl-11-phenyl-3,10,12,14-tetrazapentacyclo[11.8.0.02,10.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaen-21-one
CID 4910195
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-[4-(4-phenylphenyl)phenyl]benzimidazolo[1,2-a]benzimidazole
CID 170284536
1-methyl-2-[6-(1-methylbenzimidazol-2-yl)-4-phenyl-2-pyridinyl]benzimidazole
CID 15804948
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
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
1,2-dimethyl-3-(1-methyl-3-phenyl-2H-pyridin-1-ium-2-id-6-yl)imidazo[1,2-a]benzimidazole
CID 140932430

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyl-1-phenylimidazo[1,2-a]benzimidazole?
The IUPAC name of 2,3-dimethyl-1-phenylimidazo[1,2-a]benzimidazole (CID 158748738) is 2,3-dimethyl-1-phenylimidazo[1,2-a]benzimidazole.
What is the SMILES notation for 2,3-dimethyl-1-phenylimidazo[1,2-a]benzimidazole?
The canonical SMILES for 2,3-dimethyl-1-phenylimidazo[1,2-a]benzimidazole is Cc1c(-c2ccccc2)n2c3ccccc3nc2n1C.
What is the InChIKey of 2,3-dimethyl-1-phenylimidazo[1,2-a]benzimidazole?
The InChIKey is VRZCZQBUKLEDKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3/c1-12-16(13-8-4-3-5-9-13)20-15-11-7-6-10-14(15)18-17(20)19(12)2/h3-11H,1-2H3.
What are the key properties of 2,3-dimethyl-1-phenylimidazo[1,2-a]benzimidazole?
2,3-dimethyl-1-phenylimidazo[1,2-a]benzimidazole has a molecular weight of 261.33 g/mol, XLogP of 3.80, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-1-phenylimidazo[1,2-a]benzimidazole is sourced from PubChem (CID 158748738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).