6-methyl-2-(3-methylphenyl)-1,7-dihydropyrrolo[2,3-f]benzimidazole

C17H15N3 — CID 159713005

IUPAC6-methyl-2-(3-methylphenyl)-1,7-dihydropyrrolo[2,3-f]benzimidazole
SMILESCC1=Nc2cc3nc(-c4cccc(C)c4)[nH]c3cc2C1
InChIInChI=1S/C17H15N3/c1-10-4-3-5-12(6-10)17-19-15-8-13-7-11(2)18-14(13)9-16(15)20-17/h3-6,8-9H,7H2,1-2H3,(H,19,20)
InChIKeyRFSNUGSOBXLLHZ-UHFFFAOYSA-N
MW261.33 g/mol
LogP4.19
Rot. Bonds1

About 6-methyl-2-(3-methylphenyl)-1,7-dihydropyrrolo[2,3-f]benzimidazole

6-methyl-2-(3-methylphenyl)-1,7-dihydropyrrolo[2,3-f]benzimidazole (PubChem CID 159713005) has the molecular formula C17H15N3 and a molecular weight of 261.33 g/mol. Its IUPAC name is 6-methyl-2-(3-methylphenyl)-1,7-dihydropyrrolo[2,3-f]benzimidazole.

Molecular Properties

Compound Name6-methyl-2-(3-methylphenyl)-1,7-dihydropyrrolo[2,3-f]benzimidazole
PubChem CID159713005
Molecular FormulaC17H15N3
Molecular Weight261.33 g/mol
Exact Mass261.13
IUPAC Name6-methyl-2-(3-methylphenyl)-1,7-dihydropyrrolo[2,3-f]benzimidazole
SMILESCC1=Nc2cc3nc(-c4cccc(C)c4)[nH]c3cc2C1
InChIInChI=1S/C17H15N3/c1-10-4-3-5-12(6-10)17-19-15-8-13-7-11(2)18-14(13)9-16(15)20-17/h3-6,8-9H,7H2,1-2H3,(H,19,20)
InChIKeyRFSNUGSOBXLLHZ-UHFFFAOYSA-N
XLogP4.19
TPSA41.04 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.33
LogP ≤ 54.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

6-methyl-2-(5-methyl-2-pyridinyl)-1,7-dihydropyrrolo[2,3-f]benzimidazole
CID 159713001
6-(2-methyl-3H-indol-5-yl)-2-(5-methyl-3-pyridinyl)-1H-benzimidazole
CID 159713009
6-methyl-2-[3-(2-methyl-3,7-dihydropyrrolo[3,2-f]benzimidazol-6-yl)-5-(6-methyl-3,7-dihydropyrrolo[3,2-f]benzimidazol-2-yl)phenyl]-1,5-dihydroimidazo[4,5-f]benzimidazole
CID 164950642
6-(2-methyl-1H-indol-6-yl)-2-(3-methylphenyl)-1H-benzimidazole
CID 18683779
[2-(3-methylphenyl)-3H-benzimidazol-5-yl]methanamine
CID 79004545
ethane;bis(2-methyl-6-[2-(3-methylphenyl)-3H-benzimidazol-5-yl]-1H-benzimidazole);bis(2-methyl-6-[2-(4-methylphenyl)-3H-benzimidazol-5-yl]-1H-benzimidazole)
CID 158043672
2-methyl-6-(4-methylphenyl)-1,7-dihydropyrrolo[2,3-f]benzimidazole;sulfur trioxide
CID 162111228
6-(2-methyl-3H-indol-5-yl)-2-(5-methyl-1H-pyrazol-3-yl)-1H-benzimidazole
CID 159713006
2-(3-methylphenyl)-1H-benzimidazol-4-amine
CID 63691360
2,6-bis(4-methylphenyl)-3,5-dihydroimidazo[4,5-f]benzimidazole
CID 59482293
6-methyl-2-(3-pyrrolidin-1-ylphenyl)-1H-benzimidazole
CID 168514664
5-chloro-2-(3-methylphenyl)-1H-imidazo[4,5-b]pyridine
CID 24904041

Frequently Asked Questions

What is the IUPAC name of 6-methyl-2-(3-methylphenyl)-1,7-dihydropyrrolo[2,3-f]benzimidazole?
The IUPAC name of 6-methyl-2-(3-methylphenyl)-1,7-dihydropyrrolo[2,3-f]benzimidazole (CID 159713005) is 6-methyl-2-(3-methylphenyl)-1,7-dihydropyrrolo[2,3-f]benzimidazole.
What is the SMILES notation for 6-methyl-2-(3-methylphenyl)-1,7-dihydropyrrolo[2,3-f]benzimidazole?
The canonical SMILES for 6-methyl-2-(3-methylphenyl)-1,7-dihydropyrrolo[2,3-f]benzimidazole is CC1=Nc2cc3nc(-c4cccc(C)c4)[nH]c3cc2C1.
What is the InChIKey of 6-methyl-2-(3-methylphenyl)-1,7-dihydropyrrolo[2,3-f]benzimidazole?
The InChIKey is RFSNUGSOBXLLHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3/c1-10-4-3-5-12(6-10)17-19-15-8-13-7-11(2)18-14(13)9-16(15)20-17/h3-6,8-9H,7H2,1-2H3,(H,19,20).
What are the key properties of 6-methyl-2-(3-methylphenyl)-1,7-dihydropyrrolo[2,3-f]benzimidazole?
6-methyl-2-(3-methylphenyl)-1,7-dihydropyrrolo[2,3-f]benzimidazole has a molecular weight of 261.33 g/mol, XLogP of 4.19, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-2-(3-methylphenyl)-1,7-dihydropyrrolo[2,3-f]benzimidazole is sourced from PubChem (CID 159713005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).