4-[3-([1]benzofuro[3,2-c]carbazol-5-yl)phenyl]pyridine-3-carbonitrile

C30H17N3O — CID 146543545

IUPAC4-[3-([1]benzofuro[3,2-c]carbazol-5-yl)phenyl]pyridine-3-carbonitrile
SMILESN#Cc1cnccc1-c1cccc(-n2c3ccccc3c3c4oc5ccccc5c4ccc32)c1
InChIInChI=1S/C30H17N3O/c31-17-20-18-32-15-14-22(20)19-6-5-7-21(16-19)33-26-10-3-1-9-25(26)29-27(33)13-12-24-23-8-2-4-11-28(23)34-30(24)29/h1-16,18H
InChIKeyZLQCDZBOYQYJSE-UHFFFAOYSA-N
MW435.49 g/mol
LogP7.62
Rot. Bonds2

About 4-[3-([1]benzofuro[3,2-c]carbazol-5-yl)phenyl]pyridine-3-carbonitrile

4-[3-([1]benzofuro[3,2-c]carbazol-5-yl)phenyl]pyridine-3-carbonitrile (PubChem CID 146543545) has the molecular formula C30H17N3O and a molecular weight of 435.49 g/mol. Its IUPAC name is 4-[3-([1]benzofuro[3,2-c]carbazol-5-yl)phenyl]pyridine-3-carbonitrile.

Molecular Properties

Compound Name4-[3-([1]benzofuro[3,2-c]carbazol-5-yl)phenyl]pyridine-3-carbonitrile
PubChem CID146543545
Molecular FormulaC30H17N3O
Molecular Weight435.49 g/mol
Exact Mass435.14
IUPAC Name4-[3-([1]benzofuro[3,2-c]carbazol-5-yl)phenyl]pyridine-3-carbonitrile
SMILESN#Cc1cnccc1-c1cccc(-n2c3ccccc3c3c4oc5ccccc5c4ccc32)c1
InChIInChI=1S/C30H17N3O/c31-17-20-18-32-15-14-22(20)19-6-5-7-21(16-19)33-26-10-3-1-9-25(26)29-27(33)13-12-24-23-8-2-4-11-28(23)34-30(24)29/h1-16,18H
InChIKeyZLQCDZBOYQYJSE-UHFFFAOYSA-N
XLogP7.62
TPSA54.75 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500435.49
LogP ≤ 57.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-[3-[3-(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]phenyl]pyridine-3-carbonitrile
CID 146543067
4-[3-([1]benzofuro[3,2-c]carbazol-5-yl)phenyl]pyridine-2-carbonitrile
CID 146543546
5-[4-[3-([1]benzofuro[3,2-c]carbazol-5-yl)phenyl]phenyl]pyridine-3-carbonitrile
CID 146543091
2-[3-([1]benzofuro[3,2-c]carbazol-5-yl)-5-carbazol-9-ylphenyl]benzonitrile
CID 139340059
2-[4-[3,5-bis([1]benzofuro[3,2-c]carbazol-5-yl)phenyl]phenyl]benzonitrile
CID 139339960
5-[3-(2-carbazol-9-ylphenyl)phenyl]-[1]benzofuro[3,2-c]carbazole
CID 126652572
6-[3-[3-([1]benzofuro[3,2-c]carbazol-5-yl)phenyl]phenyl]pyridine-2-carbonitrile
CID 146543049
3-[3-([1]benzofuro[3,2-c]carbazol-5-yl)phenyl]-5-(4-phenylcarbazol-9-yl)benzonitrile
CID 129291106
6-[4-[3-([1]benzofuro[3,2-c]carbazol-5-yl)phenyl]phenyl]pyridine-3-carbonitrile
CID 146543561
2-[3-([1]benzofuro[3,2-c]carbazol-5-yl)-5-bromophenyl]benzonitrile
CID 153411277
3-[3-([1]benzofuro[3,2-c]carbazol-5-yl)phenyl]-5-(2-fluoro-[1]benzofuro[3,2-c]carbazol-5-yl)benzonitrile
CID 129291264
2-[3-[4,6-bis[2-([1]benzofuro[3,2-c]carbazol-5-yl)-4-(2-cyanophenyl)phenyl]-1,3,5-triazin-2-yl]phenyl]benzonitrile
CID 170134601

Frequently Asked Questions

What is the IUPAC name of 4-[3-([1]benzofuro[3,2-c]carbazol-5-yl)phenyl]pyridine-3-carbonitrile?
The IUPAC name of 4-[3-([1]benzofuro[3,2-c]carbazol-5-yl)phenyl]pyridine-3-carbonitrile (CID 146543545) is 4-[3-([1]benzofuro[3,2-c]carbazol-5-yl)phenyl]pyridine-3-carbonitrile.
What is the SMILES notation for 4-[3-([1]benzofuro[3,2-c]carbazol-5-yl)phenyl]pyridine-3-carbonitrile?
The canonical SMILES for 4-[3-([1]benzofuro[3,2-c]carbazol-5-yl)phenyl]pyridine-3-carbonitrile is N#Cc1cnccc1-c1cccc(-n2c3ccccc3c3c4oc5ccccc5c4ccc32)c1.
What is the InChIKey of 4-[3-([1]benzofuro[3,2-c]carbazol-5-yl)phenyl]pyridine-3-carbonitrile?
The InChIKey is ZLQCDZBOYQYJSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H17N3O/c31-17-20-18-32-15-14-22(20)19-6-5-7-21(16-19)33-26-10-3-1-9-25(26)29-27(33)13-12-24-23-8-2-4-11-28(23)34-30(24)29/h1-16,18H.
What are the key properties of 4-[3-([1]benzofuro[3,2-c]carbazol-5-yl)phenyl]pyridine-3-carbonitrile?
4-[3-([1]benzofuro[3,2-c]carbazol-5-yl)phenyl]pyridine-3-carbonitrile has a molecular weight of 435.49 g/mol, XLogP of 7.62, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-([1]benzofuro[3,2-c]carbazol-5-yl)phenyl]pyridine-3-carbonitrile is sourced from PubChem (CID 146543545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).