4-ethyl-1,2-dihydroimidazo[1,2-a]benzimidazole;hydrochloride

C11H14ClN3 — CID 13077473

IUPAC4-ethyl-1,2-dihydroimidazo[1,2-a]benzimidazole;hydrochloride
SMILESCCN1C2=NCCN2c2ccccc21.Cl
InChIInChI=1S/C11H13N3.ClH/c1-2-13-9-5-3-4-6-10(9)14-8-7-12-11(13)14;/h3-6H,2,7-8H2,1H3;1H
InChIKeyMRNFNGNQKMVQRZ-UHFFFAOYSA-N
MW223.71 g/mol
LogP2.12
Rot. Bonds1

About 4-ethyl-1,2-dihydroimidazo[1,2-a]benzimidazole;hydrochloride

4-ethyl-1,2-dihydroimidazo[1,2-a]benzimidazole;hydrochloride (PubChem CID 13077473) has the molecular formula C11H14ClN3 and a molecular weight of 223.71 g/mol. Its IUPAC name is 4-ethyl-1,2-dihydroimidazo[1,2-a]benzimidazole;hydrochloride.

Molecular Properties

Compound Name4-ethyl-1,2-dihydroimidazo[1,2-a]benzimidazole;hydrochloride
PubChem CID13077473
Molecular FormulaC11H14ClN3
Molecular Weight223.71 g/mol
Exact Mass223.09
IUPAC Name4-ethyl-1,2-dihydroimidazo[1,2-a]benzimidazole;hydrochloride
SMILESCCN1C2=NCCN2c2ccccc21.Cl
InChIInChI=1S/C11H13N3.ClH/c1-2-13-9-5-3-4-6-10(9)14-8-7-12-11(13)14;/h3-6H,2,7-8H2,1H3;1H
InChIKeyMRNFNGNQKMVQRZ-UHFFFAOYSA-N
XLogP2.12
TPSA18.84 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.71
LogP ≤ 52.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

10-ethyl-3,4-dihydro-2H-pyrimido[1,2-a]benzimidazole;hydrochloride
CID 6603340
4-[(4-tert-butylphenyl)methyl]-1,2-dihydroimidazo[1,2-a]benzimidazole;hydrochloride
CID 126476392
4-[(2-methylphenyl)methyl]-1,2-dihydroimidazo[1,2-a]benzimidazole
CID 659458
4-[(4-bromophenyl)methyl]-1,2-dihydroimidazo[1,2-a]benzimidazole
CID 765716
(2S)-1-(1,2-dihydroimidazo[1,2-a]benzimidazol-4-yl)-3,3-dimethylbutan-2-ol
CID 717649
4-butan-2-yl-1,2-dihydroimidazo[1,2-a]benzimidazole
CID 3613652
4-[(4-bromophenyl)methyl]-1,2-dihydroimidazo[1,2-a]benzimidazole;hydrobromide
CID 126476477
4-[2-(4-tert-butylphenoxy)ethyl]-1,2-dihydroimidazo[1,2-a]benzimidazole
CID 118710297
2-(1,2-dihydroimidazo[1,2-a]benzimidazol-4-yl)-1-(4-methylphenyl)ethanone
CID 2980042
10-heptyl-3,4-dihydro-2H-pyrimido[1,2-a]benzimidazole
CID 2852818
4-(1,2-dihydroimidazo[1,2-a]benzimidazol-4-ylmethyl)benzoic acid;hydrobromide
CID 155555618
4-[(3,4-dichlorophenyl)methyl]-1,2-dihydroimidazo[1,2-a]benzimidazole;hydron;chloride
CID 648020

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-1,2-dihydroimidazo[1,2-a]benzimidazole;hydrochloride?
The IUPAC name of 4-ethyl-1,2-dihydroimidazo[1,2-a]benzimidazole;hydrochloride (CID 13077473) is 4-ethyl-1,2-dihydroimidazo[1,2-a]benzimidazole;hydrochloride.
What is the SMILES notation for 4-ethyl-1,2-dihydroimidazo[1,2-a]benzimidazole;hydrochloride?
The canonical SMILES for 4-ethyl-1,2-dihydroimidazo[1,2-a]benzimidazole;hydrochloride is CCN1C2=NCCN2c2ccccc21.Cl.
What is the InChIKey of 4-ethyl-1,2-dihydroimidazo[1,2-a]benzimidazole;hydrochloride?
The InChIKey is MRNFNGNQKMVQRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3.ClH/c1-2-13-9-5-3-4-6-10(9)14-8-7-12-11(13)14;/h3-6H,2,7-8H2,1H3;1H.
What are the key properties of 4-ethyl-1,2-dihydroimidazo[1,2-a]benzimidazole;hydrochloride?
4-ethyl-1,2-dihydroimidazo[1,2-a]benzimidazole;hydrochloride has a molecular weight of 223.71 g/mol, XLogP of 2.12, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-1,2-dihydroimidazo[1,2-a]benzimidazole;hydrochloride is sourced from PubChem (CID 13077473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).