6-methyl-2-[5-[2-[2-(6-methyl-2-pyridinyl)-3,5-dihydroimidazo[4,5-f]benzimidazol-6-yl]ethyl]-2-pyridinyl]-3,5-dihydroimidazo[4,5-f]benzimidazole

C30H24N10 — CID 149282754

IUPAC6-methyl-2-[5-[2-[2-(6-methyl-2-pyridinyl)-3,5-dihydroimidazo[4,5-f]benzimidazol-6-yl]ethyl]-2-pyridinyl]-3,5-dihydroimidazo[4,5-f]benzimidazole
SMILESCc1cccc(-c2nc3cc4nc(CCc5ccc(-c6nc7cc8nc(C)[nH]c8cc7[nH]6)nc5)[nH]c4cc3[nH]2)n1
InChIInChI=1S/C30H24N10/c1-15-4-3-5-19(32-15)30-39-26-12-22-23(13-27(26)40-30)36-28(35-22)9-7-17-6-8-18(31-14-17)29-37-24-10-20-21(11-25(24)38-29)34-16(2)33-20/h3-6,8,10-14H,7,9H2,1-2H3,(H,33,34)(H,35,36)(H,37,38)(H,39,40)
InChIKeyXTGUBOILPQMEEM-UHFFFAOYSA-N
MW524.59 g/mol
LogP5.72
Rot. Bonds5

About 6-methyl-2-[5-[2-[2-(6-methyl-2-pyridinyl)-3,5-dihydroimidazo[4,5-f]benzimidazol-6-yl]ethyl]-2-pyridinyl]-3,5-dihydroimidazo[4,5-f]benzimidazole

6-methyl-2-[5-[2-[2-(6-methyl-2-pyridinyl)-3,5-dihydroimidazo[4,5-f]benzimidazol-6-yl]ethyl]-2-pyridinyl]-3,5-dihydroimidazo[4,5-f]benzimidazole (PubChem CID 149282754) has the molecular formula C30H24N10 and a molecular weight of 524.59 g/mol. Its IUPAC name is 6-methyl-2-[5-[2-[2-(6-methyl-2-pyridinyl)-3,5-dihydroimidazo[4,5-f]benzimidazol-6-yl]ethyl]-2-pyridinyl]-3,5-dihydroimidazo[4,5-f]benzimidazole.

Molecular Properties

Compound Name6-methyl-2-[5-[2-[2-(6-methyl-2-pyridinyl)-3,5-dihydroimidazo[4,5-f]benzimidazol-6-yl]ethyl]-2-pyridinyl]-3,5-dihydroimidazo[4,5-f]benzimidazole
PubChem CID149282754
Molecular FormulaC30H24N10
Molecular Weight524.59 g/mol
Exact Mass524.22
IUPAC Name6-methyl-2-[5-[2-[2-(6-methyl-2-pyridinyl)-3,5-dihydroimidazo[4,5-f]benzimidazol-6-yl]ethyl]-2-pyridinyl]-3,5-dihydroimidazo[4,5-f]benzimidazole
SMILESCc1cccc(-c2nc3cc4nc(CCc5ccc(-c6nc7cc8nc(C)[nH]c8cc7[nH]6)nc5)[nH]c4cc3[nH]2)n1
InChIInChI=1S/C30H24N10/c1-15-4-3-5-19(32-15)30-39-26-12-22-23(13-27(26)40-30)36-28(35-22)9-7-17-6-8-18(31-14-17)29-37-24-10-20-21(11-25(24)38-29)34-16(2)33-20/h3-6,8,10-14H,7,9H2,1-2H3,(H,33,34)(H,35,36)(H,37,38)(H,39,40)
InChIKeyXTGUBOILPQMEEM-UHFFFAOYSA-N
XLogP5.72
TPSA140.50 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms40
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500524.59
LogP ≤ 55.72
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

Analyze 6-methyl-2-[5-[2-[2-(6-methyl-2-pyridinyl)-3,5-dihydroimidazo[4,5-f]benzimidazol-6-yl]ethyl]-2-pyridinyl]-3,5-dihydroimidazo[4,5-f]benzimidazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-2-[5-[2-[2-(6-methyl-2-pyridinyl)-3,5-dihydroimidazo[4,5-f]benzimidazol-6-yl]ethyl]-2-pyridinyl]-3,5-dihydroimidazo[4,5-f]benzimidazole?
The IUPAC name of 6-methyl-2-[5-[2-[2-(6-methyl-2-pyridinyl)-3,5-dihydroimidazo[4,5-f]benzimidazol-6-yl]ethyl]-2-pyridinyl]-3,5-dihydroimidazo[4,5-f]benzimidazole (CID 149282754) is 6-methyl-2-[5-[2-[2-(6-methyl-2-pyridinyl)-3,5-dihydroimidazo[4,5-f]benzimidazol-6-yl]ethyl]-2-pyridinyl]-3,5-dihydroimidazo[4,5-f]benzimidazole.
What is the SMILES notation for 6-methyl-2-[5-[2-[2-(6-methyl-2-pyridinyl)-3,5-dihydroimidazo[4,5-f]benzimidazol-6-yl]ethyl]-2-pyridinyl]-3,5-dihydroimidazo[4,5-f]benzimidazole?
The canonical SMILES for 6-methyl-2-[5-[2-[2-(6-methyl-2-pyridinyl)-3,5-dihydroimidazo[4,5-f]benzimidazol-6-yl]ethyl]-2-pyridinyl]-3,5-dihydroimidazo[4,5-f]benzimidazole is Cc1cccc(-c2nc3cc4nc(CCc5ccc(-c6nc7cc8nc(C)[nH]c8cc7[nH]6)nc5)[nH]c4cc3[nH]2)n1.
What is the InChIKey of 6-methyl-2-[5-[2-[2-(6-methyl-2-pyridinyl)-3,5-dihydroimidazo[4,5-f]benzimidazol-6-yl]ethyl]-2-pyridinyl]-3,5-dihydroimidazo[4,5-f]benzimidazole?
The InChIKey is XTGUBOILPQMEEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H24N10/c1-15-4-3-5-19(32-15)30-39-26-12-22-23(13-27(26)40-30)36-28(35-22)9-7-17-6-8-18(31-14-17)29-37-24-10-20-21(11-25(24)38-29)34-16(2)33-20/h3-6,8,10-14H,7,9H2,1-2H3,(H,33,34)(H,35,36)(H,37,38)(H,39,40).
What are the key properties of 6-methyl-2-[5-[2-[2-(6-methyl-2-pyridinyl)-3,5-dihydroimidazo[4,5-f]benzimidazol-6-yl]ethyl]-2-pyridinyl]-3,5-dihydroimidazo[4,5-f]benzimidazole?
6-methyl-2-[5-[2-[2-(6-methyl-2-pyridinyl)-3,5-dihydroimidazo[4,5-f]benzimidazol-6-yl]ethyl]-2-pyridinyl]-3,5-dihydroimidazo[4,5-f]benzimidazole has a molecular weight of 524.59 g/mol, XLogP of 5.72, 5 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-2-[5-[2-[2-(6-methyl-2-pyridinyl)-3,5-dihydroimidazo[4,5-f]benzimidazol-6-yl]ethyl]-2-pyridinyl]-3,5-dihydroimidazo[4,5-f]benzimidazole is sourced from PubChem (CID 149282754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).