9-pyridin-2-yl-2-[(2-pyridin-2-yloxy-5a,9a-dihydrodibenzofuran-4-yl)oxy]carbazole

C34H23N3O3 — CID 153432022

IUPAC9-pyridin-2-yl-2-[(2-pyridin-2-yloxy-5a,9a-dihydrodibenzofuran-4-yl)oxy]carbazole
SMILESC1=CC2Oc3c(Oc4ccc5c6ccccc6n(-c6ccccn6)c5c4)cc(Oc4ccccn4)cc3C2C=C1
InChIInChI=1S/C34H23N3O3/c1-3-11-28-24(9-1)25-16-15-22(20-29(25)37(28)32-13-5-7-17-35-32)38-31-21-23(39-33-14-6-8-18-36-33)19-27-26-10-2-4-12-30(26)40-34(27)31/h1-21,26,30H
InChIKeyYGCCWFLGKUJMRH-UHFFFAOYSA-N
MW521.58 g/mol
LogP8.13
Rot. Bonds5

About 9-pyridin-2-yl-2-[(2-pyridin-2-yloxy-5a,9a-dihydrodibenzofuran-4-yl)oxy]carbazole

9-pyridin-2-yl-2-[(2-pyridin-2-yloxy-5a,9a-dihydrodibenzofuran-4-yl)oxy]carbazole (PubChem CID 153432022) has the molecular formula C34H23N3O3 and a molecular weight of 521.58 g/mol. Its IUPAC name is 9-pyridin-2-yl-2-[(2-pyridin-2-yloxy-5a,9a-dihydrodibenzofuran-4-yl)oxy]carbazole.

Molecular Properties

Compound Name9-pyridin-2-yl-2-[(2-pyridin-2-yloxy-5a,9a-dihydrodibenzofuran-4-yl)oxy]carbazole
PubChem CID153432022
Molecular FormulaC34H23N3O3
Molecular Weight521.58 g/mol
Exact Mass521.17
IUPAC Name9-pyridin-2-yl-2-[(2-pyridin-2-yloxy-5a,9a-dihydrodibenzofuran-4-yl)oxy]carbazole
SMILESC1=CC2Oc3c(Oc4ccc5c6ccccc6n(-c6ccccn6)c5c4)cc(Oc4ccccn4)cc3C2C=C1
InChIInChI=1S/C34H23N3O3/c1-3-11-28-24(9-1)25-16-15-22(20-29(25)37(28)32-13-5-7-17-35-32)38-31-21-23(39-33-14-6-8-18-36-33)19-27-26-10-2-4-12-30(26)40-34(27)31/h1-21,26,30H
InChIKeyYGCCWFLGKUJMRH-UHFFFAOYSA-N
XLogP8.13
TPSA58.40 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms40
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500521.58
LogP ≤ 58.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

2-(3-pyrazol-1-ylphenoxy)-9-pyridin-2-ylcarbazole
CID 140794986
2-[9-(4-tert-butyl-2-pyridinyl)carbazol-2-yl]oxy-9-pyridin-2-ylcarbazole
CID 160515375
11-pyridin-2-yl-2-(2-pyridin-2-yloxycarbazol-9-yl)benzo[b][1]benzazepine
CID 157331126
5-carbazol-9-yl-2-(9-pyridin-2-ylcarbazol-2-yl)oxyquinolin-8-ol
CID 176606537
9-(9-pyridin-2-ylcarbazol-2-yl)oxy-2,5,17-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),3,5,7(12),8,10,14,16-octaene
CID 140948681
6-(9-pyridin-2-ylcarbazol-2-yl)oxy-[1,2,4]triazolo[1,5-f]phenanthridine
CID 153411413
2-[3-(9-pyridin-2-ylcarbazol-2-yl)oxyphenyl]-1,3-oxazole
CID 141495117
2-[3-(4-phenyltriazol-1-yl)phenoxy]-9-pyridin-2-ylcarbazole
CID 170654817
9-(3,4-dideuterio-2-pyridinyl)-2-(3-pyridin-2-yloxyphenyl)carbazole
CID 153421326
2-[(2-propan-2-yl-6-pyrazol-1-yl-4-pyridinyl)oxy]-9-pyridin-2-ylcarbazole
CID 155675531
2-[3-(3-phenyl-2H-imidazol-1-yl)phenoxy]-9-pyridin-2-ylcarbazole
CID 160515373
9-(3,5-dideuterio-2-pyridinyl)-2-(3-pyridin-2-yloxyphenyl)carbazole
CID 153421777

Frequently Asked Questions

What is the IUPAC name of 9-pyridin-2-yl-2-[(2-pyridin-2-yloxy-5a,9a-dihydrodibenzofuran-4-yl)oxy]carbazole?
The IUPAC name of 9-pyridin-2-yl-2-[(2-pyridin-2-yloxy-5a,9a-dihydrodibenzofuran-4-yl)oxy]carbazole (CID 153432022) is 9-pyridin-2-yl-2-[(2-pyridin-2-yloxy-5a,9a-dihydrodibenzofuran-4-yl)oxy]carbazole.
What is the SMILES notation for 9-pyridin-2-yl-2-[(2-pyridin-2-yloxy-5a,9a-dihydrodibenzofuran-4-yl)oxy]carbazole?
The canonical SMILES for 9-pyridin-2-yl-2-[(2-pyridin-2-yloxy-5a,9a-dihydrodibenzofuran-4-yl)oxy]carbazole is C1=CC2Oc3c(Oc4ccc5c6ccccc6n(-c6ccccn6)c5c4)cc(Oc4ccccn4)cc3C2C=C1.
What is the InChIKey of 9-pyridin-2-yl-2-[(2-pyridin-2-yloxy-5a,9a-dihydrodibenzofuran-4-yl)oxy]carbazole?
The InChIKey is YGCCWFLGKUJMRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H23N3O3/c1-3-11-28-24(9-1)25-16-15-22(20-29(25)37(28)32-13-5-7-17-35-32)38-31-21-23(39-33-14-6-8-18-36-33)19-27-26-10-2-4-12-30(26)40-34(27)31/h1-21,26,30H.
What are the key properties of 9-pyridin-2-yl-2-[(2-pyridin-2-yloxy-5a,9a-dihydrodibenzofuran-4-yl)oxy]carbazole?
9-pyridin-2-yl-2-[(2-pyridin-2-yloxy-5a,9a-dihydrodibenzofuran-4-yl)oxy]carbazole has a molecular weight of 521.58 g/mol, XLogP of 8.13, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 9-pyridin-2-yl-2-[(2-pyridin-2-yloxy-5a,9a-dihydrodibenzofuran-4-yl)oxy]carbazole is sourced from PubChem (CID 153432022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).