9-(2-bromophenyl)pyrido[2,3-b]indole

C17H11BrN2 — CID 170774308

IUPAC9-(2-bromophenyl)pyrido[2,3-b]indole
SMILESBrc1ccccc1-n1c2ccccc2c2cccnc21
InChIInChI=1S/C17H11BrN2/c18-14-8-2-4-10-16(14)20-15-9-3-1-6-12(15)13-7-5-11-19-17(13)20/h1-11H
InChIKeyLYNDSLTYRJUBBC-UHFFFAOYSA-N
MW323.19 g/mol
LogP4.94
Rot. Bonds1

About 9-(2-bromophenyl)pyrido[2,3-b]indole

9-(2-bromophenyl)pyrido[2,3-b]indole (PubChem CID 170774308) has the molecular formula C17H11BrN2 and a molecular weight of 323.19 g/mol. Its IUPAC name is 9-(2-bromophenyl)pyrido[2,3-b]indole.

Molecular Properties

Compound Name9-(2-bromophenyl)pyrido[2,3-b]indole
PubChem CID170774308
Molecular FormulaC17H11BrN2
Molecular Weight323.19 g/mol
Exact Mass322.01
IUPAC Name9-(2-bromophenyl)pyrido[2,3-b]indole
SMILESBrc1ccccc1-n1c2ccccc2c2cccnc21
InChIInChI=1S/C17H11BrN2/c18-14-8-2-4-10-16(14)20-15-9-3-1-6-12(15)13-7-5-11-19-17(13)20/h1-11H
InChIKeyLYNDSLTYRJUBBC-UHFFFAOYSA-N
XLogP4.94
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.19
LogP ≤ 54.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

9-phenylpyrido[2,3-b]indole
CID 15939260
9-(4,6-diphenyl-1,3,5-triazin-2-yl)pyrido[2,3-b]indole
CID 70836919
9-[2-(2-carbazol-9-yl-6-phenylpyrimidin-4-yl)phenyl]pyrido[2,3-b]indole
CID 176634730
6-pyrido[2,3-b]indol-9-yl-9-tetraphenylen-2-ylpyrido[2,3-b]indole
CID 137095996
9-methylpyrido[2,3-b]indole
CID 12596580
9-[5-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]-2-phenylphenyl]pyrido[2,3-b]indole
CID 170659259
10-pyrido[2,3-b]indol-9-yl-3,24-diazapentacyclo[18.4.0.02,7.08,13.014,19]tetracosa-1(20),2(7),3,5,8(13),9,11,14,16,18,21,23-dodecaene
CID 140920315
6-(3-carbazol-9-ylcarbazol-9-yl)-9-phenylpyrido[2,3-b]indole
CID 168845228
3-(2-carbazol-9-ylphenyl)-5-(6,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)benzonitrile
CID 167507200
6-[2-(3-carbazol-9-ylcarbazol-9-yl)phenyl]-9-(4-phenylphenyl)pyrido[2,3-b]indole
CID 170064512
9-(8-pyrido[2,3-b]indol-9-yldibenzothiophen-2-yl)pyrido[2,3-b]indole
CID 132568147
6-pyrido[2,3-b]indol-9-yl-9-[3-(6-pyrido[2,3-b]indol-9-ylpyrido[2,3-b]indol-9-yl)-1-benzothiophen-5-yl]pyrido[2,3-b]indole
CID 90251064

Frequently Asked Questions

What is the IUPAC name of 9-(2-bromophenyl)pyrido[2,3-b]indole?
The IUPAC name of 9-(2-bromophenyl)pyrido[2,3-b]indole (CID 170774308) is 9-(2-bromophenyl)pyrido[2,3-b]indole.
What is the SMILES notation for 9-(2-bromophenyl)pyrido[2,3-b]indole?
The canonical SMILES for 9-(2-bromophenyl)pyrido[2,3-b]indole is Brc1ccccc1-n1c2ccccc2c2cccnc21.
What is the InChIKey of 9-(2-bromophenyl)pyrido[2,3-b]indole?
The InChIKey is LYNDSLTYRJUBBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H11BrN2/c18-14-8-2-4-10-16(14)20-15-9-3-1-6-12(15)13-7-5-11-19-17(13)20/h1-11H.
What are the key properties of 9-(2-bromophenyl)pyrido[2,3-b]indole?
9-(2-bromophenyl)pyrido[2,3-b]indole has a molecular weight of 323.19 g/mol, XLogP of 4.94, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(2-bromophenyl)pyrido[2,3-b]indole is sourced from PubChem (CID 170774308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).