2-(1-methyl-2-phenyl-5,7-dihydropyrrolo[3,4-f]benzimidazol-6-yl)ethanol

C18H19N3O — CID 82164211

IUPAC2-(1-methyl-2-phenyl-5,7-dihydropyrrolo[3,4-f]benzimidazol-6-yl)ethanol
SMILESCn1c(-c2ccccc2)nc2cc3c(cc21)CN(CCO)C3
InChIInChI=1S/C18H19N3O/c1-20-17-10-15-12-21(7-8-22)11-14(15)9-16(17)19-18(20)13-5-3-2-4-6-13/h2-6,9-10,22H,7-8,11-12H2,1H3
InChIKeyJDUUAQCMQDGLKE-UHFFFAOYSA-N
MW293.37 g/mol
LogP2.55
Rot. Bonds3

About 2-(1-methyl-2-phenyl-5,7-dihydropyrrolo[3,4-f]benzimidazol-6-yl)ethanol

2-(1-methyl-2-phenyl-5,7-dihydropyrrolo[3,4-f]benzimidazol-6-yl)ethanol (PubChem CID 82164211) has the molecular formula C18H19N3O and a molecular weight of 293.37 g/mol. Its IUPAC name is 2-(1-methyl-2-phenyl-5,7-dihydropyrrolo[3,4-f]benzimidazol-6-yl)ethanol.

Molecular Properties

Compound Name2-(1-methyl-2-phenyl-5,7-dihydropyrrolo[3,4-f]benzimidazol-6-yl)ethanol
PubChem CID82164211
Molecular FormulaC18H19N3O
Molecular Weight293.37 g/mol
Exact Mass293.15
IUPAC Name2-(1-methyl-2-phenyl-5,7-dihydropyrrolo[3,4-f]benzimidazol-6-yl)ethanol
SMILESCn1c(-c2ccccc2)nc2cc3c(cc21)CN(CCO)C3
InChIInChI=1S/C18H19N3O/c1-20-17-10-15-12-21(7-8-22)11-14(15)9-16(17)19-18(20)13-5-3-2-4-6-13/h2-6,9-10,22H,7-8,11-12H2,1H3
InChIKeyJDUUAQCMQDGLKE-UHFFFAOYSA-N
XLogP2.55
TPSA41.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(1-methyl-2-phenyl-5,7-dihydropyrrolo[3,4-f]benzimidazol-6-yl)propan-1-ol
CID 94778853
6-chloro-1-methyl-2-phenylbenzimidazole
CID 12738431
3-(1-methyl-2-propan-2-yl-5,7-dihydropyrrolo[3,4-f]benzimidazol-6-yl)propanoic acid
CID 82164190
1,5-dimethyl-2-phenylbenzimidazole;2-phenyl-1-(2-phenylphenyl)benzimidazole
CID 143996079
N,N-dimethyl-1-[[4-(3-methyl-2-phenylbenzimidazol-5-yl)phenyl]methyl]piperidin-4-amine
CID 162735853
N-methyl-1-(1-methyl-2-phenylbenzimidazol-5-yl)ethanamine
CID 82501622
6-cyclohepta-1,6-dien-1-yl-1-methyl-2-phenylbenzimidazole
CID 145498339
2-[2-[4-[1-(2-hydroxyethyl)benzimidazol-2-yl]phenyl]benzimidazol-1-yl]ethanol
CID 174213303
2-(5-chloro-1,3-dihydroisoindol-2-yl)ethanol
CID 82164081
2-(5-bromo-1,3-dihydroisoindol-2-yl)ethanol
CID 82164047
3-(2-hydroxyethyl)-2-phenylquinazolin-4-one
CID 854542
3-methyl-2-(4-methylphenyl)benzimidazol-5-ol
CID 84700718

Frequently Asked Questions

What is the IUPAC name of 2-(1-methyl-2-phenyl-5,7-dihydropyrrolo[3,4-f]benzimidazol-6-yl)ethanol?
The IUPAC name of 2-(1-methyl-2-phenyl-5,7-dihydropyrrolo[3,4-f]benzimidazol-6-yl)ethanol (CID 82164211) is 2-(1-methyl-2-phenyl-5,7-dihydropyrrolo[3,4-f]benzimidazol-6-yl)ethanol.
What is the SMILES notation for 2-(1-methyl-2-phenyl-5,7-dihydropyrrolo[3,4-f]benzimidazol-6-yl)ethanol?
The canonical SMILES for 2-(1-methyl-2-phenyl-5,7-dihydropyrrolo[3,4-f]benzimidazol-6-yl)ethanol is Cn1c(-c2ccccc2)nc2cc3c(cc21)CN(CCO)C3.
What is the InChIKey of 2-(1-methyl-2-phenyl-5,7-dihydropyrrolo[3,4-f]benzimidazol-6-yl)ethanol?
The InChIKey is JDUUAQCMQDGLKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O/c1-20-17-10-15-12-21(7-8-22)11-14(15)9-16(17)19-18(20)13-5-3-2-4-6-13/h2-6,9-10,22H,7-8,11-12H2,1H3.
What are the key properties of 2-(1-methyl-2-phenyl-5,7-dihydropyrrolo[3,4-f]benzimidazol-6-yl)ethanol?
2-(1-methyl-2-phenyl-5,7-dihydropyrrolo[3,4-f]benzimidazol-6-yl)ethanol has a molecular weight of 293.37 g/mol, XLogP of 2.55, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methyl-2-phenyl-5,7-dihydropyrrolo[3,4-f]benzimidazol-6-yl)ethanol is sourced from PubChem (CID 82164211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).