9-iodo-7-pyridin-3-ylpyrido[2,3-b]indole

C16H10IN3 — CID 134492836

IUPAC9-iodo-7-pyridin-3-ylpyrido[2,3-b]indole
SMILESIn1c2cc(-c3cccnc3)ccc2c2cccnc21
InChIInChI=1S/C16H10IN3/c17-20-15-9-11(12-3-1-7-18-10-12)5-6-13(15)14-4-2-8-19-16(14)20/h1-10H
InChIKeyWTSYKRONYYBETG-UHFFFAOYSA-N
MW371.18 g/mol
LogP4.45
Rot. Bonds1

About 9-iodo-7-pyridin-3-ylpyrido[2,3-b]indole

9-iodo-7-pyridin-3-ylpyrido[2,3-b]indole (PubChem CID 134492836) has the molecular formula C16H10IN3 and a molecular weight of 371.18 g/mol. Its IUPAC name is 9-iodo-7-pyridin-3-ylpyrido[2,3-b]indole.

Molecular Properties

Compound Name9-iodo-7-pyridin-3-ylpyrido[2,3-b]indole
PubChem CID134492836
Molecular FormulaC16H10IN3
Molecular Weight371.18 g/mol
Exact Mass370.99
IUPAC Name9-iodo-7-pyridin-3-ylpyrido[2,3-b]indole
SMILESIn1c2cc(-c3cccnc3)ccc2c2cccnc21
InChIInChI=1S/C16H10IN3/c17-20-15-9-11(12-3-1-7-18-10-12)5-6-13(15)14-4-2-8-19-16(14)20/h1-10H
InChIKeyWTSYKRONYYBETG-UHFFFAOYSA-N
XLogP4.45
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.18
LogP ≤ 54.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

9-[4-[2-phenyl-6-(4-pyridin-3-ylphenyl)pyrimidin-4-yl]phenyl]pyrido[2,3-b]indole
CID 121422859
3-(9,10-dinaphthalen-2-ylanthracen-2-yl)pyridine
CID 58592230
9-(4-phenylphenyl)-7-[9-(4-phenylphenyl)carbazol-2-yl]pyrido[2,3-b]indole
CID 118587534
9-[5-(4-isoquinolin-4-yl-6-pyridin-3-yl-2-pyridinyl)-2-pyridinyl]pyrido[2,3-b]indole
CID 59609449
2-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-pyridin-3-ylphenyl]carbazole
CID 138579049
3-[4-(9-naphthalen-2-yl-10-phenylanthracen-2-yl)phenyl]pyridine
CID 90361582
2-[3-pyridin-3-yl-5-(4-triphenylen-2-ylphenyl)phenyl]pyridine
CID 118583016
5-(4-pyridin-3-ylphenyl)-9-oxa-1,18-diazahexacyclo[15.7.0.02,10.03,8.011,16.019,24]tetracosa-2(10),3(8),4,6,11,13,15,17,19,21,23-undecaene
CID 129127949
3,9-diphenylcarbazole;3-(9-phenylcarbazol-3-yl)-9-(4-pyridin-3-ylphenyl)carbazole
CID 160711176
2-[5-[6,10-bis[6-(5-pyridin-2-yl-2-pyridinyl)-3-pyridinyl]triphenylen-2-yl]-2-pyridinyl]-5-pyridin-2-ylpyridine;2-pyridin-2-yl-5-[5-[11-[6-(6-pyridin-2-yl-3-pyridinyl)-3-pyridinyl]triphenylen-2-yl]-2-pyridinyl]pyridine;2-pyridin-3-yl-5-[5-[11-[6-(6-pyridin-3-yl-3-pyridinyl)-3-pyridinyl]triphenylen-2-yl]-2-pyridinyl]pyridine
CID 158248176
3-(5-methylnaphthalen-2-yl)pyridine
CID 126628486
2-pyridin-3-yl-9H-carbazole
CID 175799429

Frequently Asked Questions

What is the IUPAC name of 9-iodo-7-pyridin-3-ylpyrido[2,3-b]indole?
The IUPAC name of 9-iodo-7-pyridin-3-ylpyrido[2,3-b]indole (CID 134492836) is 9-iodo-7-pyridin-3-ylpyrido[2,3-b]indole.
What is the SMILES notation for 9-iodo-7-pyridin-3-ylpyrido[2,3-b]indole?
The canonical SMILES for 9-iodo-7-pyridin-3-ylpyrido[2,3-b]indole is In1c2cc(-c3cccnc3)ccc2c2cccnc21.
What is the InChIKey of 9-iodo-7-pyridin-3-ylpyrido[2,3-b]indole?
The InChIKey is WTSYKRONYYBETG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10IN3/c17-20-15-9-11(12-3-1-7-18-10-12)5-6-13(15)14-4-2-8-19-16(14)20/h1-10H.
What are the key properties of 9-iodo-7-pyridin-3-ylpyrido[2,3-b]indole?
9-iodo-7-pyridin-3-ylpyrido[2,3-b]indole has a molecular weight of 371.18 g/mol, XLogP of 4.45, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-iodo-7-pyridin-3-ylpyrido[2,3-b]indole is sourced from PubChem (CID 134492836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).