9-pyridin-2-yl-6-[4-(10-pyridin-2-ylanthracen-9-yl)phenyl]pyrido[2,3-b]indole

C41H26N4 — CID 118403871

IUPAC9-pyridin-2-yl-6-[4-(10-pyridin-2-ylanthracen-9-yl)phenyl]pyrido[2,3-b]indole
SMILESc1ccc(-c2c3ccccc3c(-c3ccc(-c4ccc5c(c4)c4cccnc4n5-c4ccccn4)cc3)c3ccccc23)nc1
InChIInChI=1S/C41H26N4/c1-3-12-32-30(10-1)39(31-11-2-4-13-33(31)40(32)36-15-5-7-23-42-36)28-19-17-27(18-20-28)29-21-22-37-35(26-29)34-14-9-25-44-41(34)45(37)38-16-6-8-24-43-38/h1-26H
InChIKeyDPIPPZLDCJHALL-UHFFFAOYSA-N
MW574.69 g/mol
LogP10.28
Rot. Bonds4

About 9-pyridin-2-yl-6-[4-(10-pyridin-2-ylanthracen-9-yl)phenyl]pyrido[2,3-b]indole

9-pyridin-2-yl-6-[4-(10-pyridin-2-ylanthracen-9-yl)phenyl]pyrido[2,3-b]indole (PubChem CID 118403871) has the molecular formula C41H26N4 and a molecular weight of 574.69 g/mol. Its IUPAC name is 9-pyridin-2-yl-6-[4-(10-pyridin-2-ylanthracen-9-yl)phenyl]pyrido[2,3-b]indole.

Molecular Properties

Compound Name9-pyridin-2-yl-6-[4-(10-pyridin-2-ylanthracen-9-yl)phenyl]pyrido[2,3-b]indole
PubChem CID118403871
Molecular FormulaC41H26N4
Molecular Weight574.69 g/mol
Exact Mass574.22
IUPAC Name9-pyridin-2-yl-6-[4-(10-pyridin-2-ylanthracen-9-yl)phenyl]pyrido[2,3-b]indole
SMILESc1ccc(-c2c3ccccc3c(-c3ccc(-c4ccc5c(c4)c4cccnc4n5-c4ccccn4)cc3)c3ccccc23)nc1
InChIInChI=1S/C41H26N4/c1-3-12-32-30(10-1)39(31-11-2-4-13-33(31)40(32)36-15-5-7-23-42-36)28-19-17-27(18-20-28)29-21-22-37-35(26-29)34-14-9-25-44-41(34)45(37)38-16-6-8-24-43-38/h1-26H
InChIKeyDPIPPZLDCJHALL-UHFFFAOYSA-N
XLogP10.28
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms45
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500574.69
LogP ≤ 510.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

Analyze 9-pyridin-2-yl-6-[4-(10-pyridin-2-ylanthracen-9-yl)phenyl]pyrido[2,3-b]indole with MolForge

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Related Compounds

2-[4-[4-(9-pyridin-2-ylpyrido[2,3-b]indol-6-yl)phenyl]phenyl]-1,10-phenanthroline
CID 118403848
6-iodo-9-pyridin-2-ylpyrido[2,3-b]indole
CID 134576120
6-[4-(6-phenylpyren-1-yl)naphthalen-1-yl]-9-pyridin-2-ylpyrido[2,3-b]indole
CID 118885855
N-[3-[(Z)-prop-1-enyl]-1-pyridin-2-yl-5-(9-pyridin-2-ylpyrido[2,3-b]indol-6-yl)indol-2-yl]methanimine
CID 138625411
2-[6-[10-(9-pyridin-2-ylpyrido[2,3-b]indol-7-yl)anthracen-9-yl]naphthalen-2-yl]-1,10-phenanthroline
CID 145221280
9-phenyl-6-(5-pyridin-2-yl-2-pyridinyl)pyrido[2,3-b]indole
CID 118403810
9-phenyl-6-(10-pyridin-2-ylanthracen-9-yl)pyrido[2,3-b]indole;2-[10-(9-phenylpyrido[2,3-b]indol-6-yl)anthracen-9-yl]-1,10-phenanthroline;9-phenyl-6-(10-quinolin-2-ylanthracen-9-yl)pyrido[2,3-b]indole
CID 159575994
9-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]-6-(9-phenylcarbazol-2-yl)pyrido[2,3-b]indole
CID 129221681
3-(9-iodocarbazol-3-yl)-9-pyridin-2-ylcarbazole
CID 135198280
9-(3,5-dipyridin-2-ylphenyl)-6-(9-phenylcarbazol-2-yl)pyrido[2,3-b]indole
CID 118587520
6-(12,12-dimethylspiro[indeno[1,2-b]fluorene-6,2'-tricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,9,11,13-heptaene]-5'-yl)-9-pyridin-2-ylpyrido[2,3-b]indole
CID 134258451
9-pyridin-2-yl-2-(2-pyridin-2-ylcarbazol-9-yl)pyrido[2,3-b]indole
CID 155655282

Frequently Asked Questions

What is the IUPAC name of 9-pyridin-2-yl-6-[4-(10-pyridin-2-ylanthracen-9-yl)phenyl]pyrido[2,3-b]indole?
The IUPAC name of 9-pyridin-2-yl-6-[4-(10-pyridin-2-ylanthracen-9-yl)phenyl]pyrido[2,3-b]indole (CID 118403871) is 9-pyridin-2-yl-6-[4-(10-pyridin-2-ylanthracen-9-yl)phenyl]pyrido[2,3-b]indole.
What is the SMILES notation for 9-pyridin-2-yl-6-[4-(10-pyridin-2-ylanthracen-9-yl)phenyl]pyrido[2,3-b]indole?
The canonical SMILES for 9-pyridin-2-yl-6-[4-(10-pyridin-2-ylanthracen-9-yl)phenyl]pyrido[2,3-b]indole is c1ccc(-c2c3ccccc3c(-c3ccc(-c4ccc5c(c4)c4cccnc4n5-c4ccccn4)cc3)c3ccccc23)nc1.
What is the InChIKey of 9-pyridin-2-yl-6-[4-(10-pyridin-2-ylanthracen-9-yl)phenyl]pyrido[2,3-b]indole?
The InChIKey is DPIPPZLDCJHALL-UHFFFAOYSA-N. The full InChI is InChI=1S/C41H26N4/c1-3-12-32-30(10-1)39(31-11-2-4-13-33(31)40(32)36-15-5-7-23-42-36)28-19-17-27(18-20-28)29-21-22-37-35(26-29)34-14-9-25-44-41(34)45(37)38-16-6-8-24-43-38/h1-26H.
What are the key properties of 9-pyridin-2-yl-6-[4-(10-pyridin-2-ylanthracen-9-yl)phenyl]pyrido[2,3-b]indole?
9-pyridin-2-yl-6-[4-(10-pyridin-2-ylanthracen-9-yl)phenyl]pyrido[2,3-b]indole has a molecular weight of 574.69 g/mol, XLogP of 10.28, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 9-pyridin-2-yl-6-[4-(10-pyridin-2-ylanthracen-9-yl)phenyl]pyrido[2,3-b]indole is sourced from PubChem (CID 118403871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).