9-[3-[[4-(3-methyl-2H-benzimidazol-1-yl)-2-pyridinyl]oxy]phenyl]pyrido[2,3-b]indole

C30H23N5O — CID 168848406

IUPAC9-[3-[[4-(3-methyl-2H-benzimidazol-1-yl)-2-pyridinyl]oxy]phenyl]pyrido[2,3-b]indole
SMILESCN1CN(c2ccnc(Oc3cccc(-n4c5ccccc5c5cccnc54)c3)c2)c2ccccc21
InChIInChI=1S/C30H23N5O/c1-33-20-34(28-14-5-4-13-27(28)33)21-15-17-31-29(19-21)36-23-9-6-8-22(18-23)35-26-12-3-2-10-24(26)25-11-7-16-32-30(25)35/h2-19H,20H2,1H3
InChIKeyFYIUVKPCVWGQKM-UHFFFAOYSA-N
MW469.55 g/mol
LogP6.91
Rot. Bonds4

About 9-[3-[[4-(3-methyl-2H-benzimidazol-1-yl)-2-pyridinyl]oxy]phenyl]pyrido[2,3-b]indole

9-[3-[[4-(3-methyl-2H-benzimidazol-1-yl)-2-pyridinyl]oxy]phenyl]pyrido[2,3-b]indole (PubChem CID 168848406) has the molecular formula C30H23N5O and a molecular weight of 469.55 g/mol. Its IUPAC name is 9-[3-[[4-(3-methyl-2H-benzimidazol-1-yl)-2-pyridinyl]oxy]phenyl]pyrido[2,3-b]indole.

Molecular Properties

Compound Name9-[3-[[4-(3-methyl-2H-benzimidazol-1-yl)-2-pyridinyl]oxy]phenyl]pyrido[2,3-b]indole
PubChem CID168848406
Molecular FormulaC30H23N5O
Molecular Weight469.55 g/mol
Exact Mass469.19
IUPAC Name9-[3-[[4-(3-methyl-2H-benzimidazol-1-yl)-2-pyridinyl]oxy]phenyl]pyrido[2,3-b]indole
SMILESCN1CN(c2ccnc(Oc3cccc(-n4c5ccccc5c5cccnc54)c3)c2)c2ccccc21
InChIInChI=1S/C30H23N5O/c1-33-20-34(28-14-5-4-13-27(28)33)21-15-17-31-29(19-21)36-23-9-6-8-22(18-23)35-26-12-3-2-10-24(26)25-11-7-16-32-30(25)35/h2-19H,20H2,1H3
InChIKeyFYIUVKPCVWGQKM-UHFFFAOYSA-N
XLogP6.91
TPSA46.42 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500469.55
LogP ≤ 56.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 9-[3-[[4-(3-methyl-2H-benzimidazol-1-yl)-2-pyridinyl]oxy]phenyl]pyrido[2,3-b]indole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

9-[3-[3-[3-(3-tert-butyl-5-phenylphenyl)-2H-benzimidazol-1-yl]phenoxy]phenyl]pyrido[2,3-b]indole
CID 155650771
2-[3-(3-methyl-2H-benzimidazol-1-yl)phenoxy]-9-phenylcarbazole
CID 165154915
9-[9-(3-pyridin-2-yloxyphenyl)carbazol-2-yl]pyrido[2,3-b]indole
CID 140680930
9-[4-(9H-fluoren-9-yl)-2-pyridinyl]-2-[[4-(3-methyl-2H-benzimidazol-1-yl)-2-pyridinyl]oxy]carbazole
CID 168848410
1-methyl-3-[2-[3-(1-methyltriazol-4-yl)phenoxy]-4-pyridinyl]-2H-benzimidazole
CID 168848612
1-[2-[3-[(4-tert-butyl-2-pyridinyl)sulfanyl]phenoxy]-4-pyridinyl]-3-methyl-2H-benzimidazole
CID 168848516
9-[3-(3-methyl-2H-benzimidazol-1-yl)phenyl]-7-(1-methyl-5-phenylbenzimidazol-2-yl)pyrido[2,3-b]indole
CID 153285387
9-pyridin-2-yl-2-[3-(3,5,6-trimethyl-2H-benzimidazol-1-yl)phenoxy]carbazole
CID 155606671
2-[[4-(6-tert-butyl-3-methyl-2H-benzimidazol-1-yl)-2-pyridinyl]oxy]-9-(4-tert-butyl-2-pyridinyl)pyrido[2,3-b]indole
CID 168848602
9-[3-(3-methyl-2H-benzimidazol-1-yl)phenyl]-7-(1-methyl-7-phenylbenzimidazol-2-yl)pyrido[2,3-b]indole
CID 153285355
2-[3-(6-tert-butyl-3-methyl-2H-benzimidazol-1-yl)phenoxy]-9-(4-tert-butyl-2-pyridinyl)carbazole
CID 155606525
9-(4-tert-butyl-2-pyridinyl)-2-[[4-[3-(2,6-dimethylphenyl)-2H-benzimidazol-1-yl]-2-pyridinyl]oxy]carbazole
CID 168848644

Frequently Asked Questions

What is the IUPAC name of 9-[3-[[4-(3-methyl-2H-benzimidazol-1-yl)-2-pyridinyl]oxy]phenyl]pyrido[2,3-b]indole?
The IUPAC name of 9-[3-[[4-(3-methyl-2H-benzimidazol-1-yl)-2-pyridinyl]oxy]phenyl]pyrido[2,3-b]indole (CID 168848406) is 9-[3-[[4-(3-methyl-2H-benzimidazol-1-yl)-2-pyridinyl]oxy]phenyl]pyrido[2,3-b]indole.
What is the SMILES notation for 9-[3-[[4-(3-methyl-2H-benzimidazol-1-yl)-2-pyridinyl]oxy]phenyl]pyrido[2,3-b]indole?
The canonical SMILES for 9-[3-[[4-(3-methyl-2H-benzimidazol-1-yl)-2-pyridinyl]oxy]phenyl]pyrido[2,3-b]indole is CN1CN(c2ccnc(Oc3cccc(-n4c5ccccc5c5cccnc54)c3)c2)c2ccccc21.
What is the InChIKey of 9-[3-[[4-(3-methyl-2H-benzimidazol-1-yl)-2-pyridinyl]oxy]phenyl]pyrido[2,3-b]indole?
The InChIKey is FYIUVKPCVWGQKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H23N5O/c1-33-20-34(28-14-5-4-13-27(28)33)21-15-17-31-29(19-21)36-23-9-6-8-22(18-23)35-26-12-3-2-10-24(26)25-11-7-16-32-30(25)35/h2-19H,20H2,1H3.
What are the key properties of 9-[3-[[4-(3-methyl-2H-benzimidazol-1-yl)-2-pyridinyl]oxy]phenyl]pyrido[2,3-b]indole?
9-[3-[[4-(3-methyl-2H-benzimidazol-1-yl)-2-pyridinyl]oxy]phenyl]pyrido[2,3-b]indole has a molecular weight of 469.55 g/mol, XLogP of 6.91, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[3-[[4-(3-methyl-2H-benzimidazol-1-yl)-2-pyridinyl]oxy]phenyl]pyrido[2,3-b]indole is sourced from PubChem (CID 168848406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).