2-[3-(7-phenylbenzo[c]carbazol-5-yl)phenyl]pyridine-4-carbonitrile

C34H21N3 — CID 118397516

IUPAC2-[3-(7-phenylbenzo[c]carbazol-5-yl)phenyl]pyridine-4-carbonitrile
SMILESN#Cc1ccnc(-c2cccc(-c3cc4c(c5ccccc35)c3ccccc3n4-c3ccccc3)c2)c1
InChIInChI=1S/C34H21N3/c35-22-23-17-18-36-31(19-23)25-10-8-9-24(20-25)30-21-33-34(28-14-5-4-13-27(28)30)29-15-6-7-16-32(29)37(33)26-11-2-1-3-12-26/h1-21H
InChIKeyJLIHJISYAPEGCL-UHFFFAOYSA-N
MW471.56 g/mol
LogP8.54
Rot. Bonds3

About 2-[3-(7-phenylbenzo[c]carbazol-5-yl)phenyl]pyridine-4-carbonitrile

2-[3-(7-phenylbenzo[c]carbazol-5-yl)phenyl]pyridine-4-carbonitrile (PubChem CID 118397516) has the molecular formula C34H21N3 and a molecular weight of 471.56 g/mol. Its IUPAC name is 2-[3-(7-phenylbenzo[c]carbazol-5-yl)phenyl]pyridine-4-carbonitrile.

Molecular Properties

Compound Name2-[3-(7-phenylbenzo[c]carbazol-5-yl)phenyl]pyridine-4-carbonitrile
PubChem CID118397516
Molecular FormulaC34H21N3
Molecular Weight471.56 g/mol
Exact Mass471.17
IUPAC Name2-[3-(7-phenylbenzo[c]carbazol-5-yl)phenyl]pyridine-4-carbonitrile
SMILESN#Cc1ccnc(-c2cccc(-c3cc4c(c5ccccc35)c3ccccc3n4-c3ccccc3)c2)c1
InChIInChI=1S/C34H21N3/c35-22-23-17-18-36-31(19-23)25-10-8-9-24(20-25)30-21-33-34(28-14-5-4-13-27(28)30)29-15-6-7-16-32(29)37(33)26-11-2-1-3-12-26/h1-21H
InChIKeyJLIHJISYAPEGCL-UHFFFAOYSA-N
XLogP8.54
TPSA41.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms37
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500471.56
LogP ≤ 58.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-[5-(7-phenylbenzo[c]carbazol-5-yl)-2-pyridinyl]pyridine-4-carbonitrile
CID 118397522
2-[3-(2-carbazol-9-ylphenyl)phenyl]pyridine-4-carbonitrile
CID 146543414
2-[5-[15-[6-(4-cyano-2-pyridinyl)-3-pyridinyl]-12-phenyl-12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaen-9-yl]-2-pyridinyl]pyridine-4-carbonitrile
CID 118397792
2-[3-[12-[3-(4-cyano-2-pyridinyl)phenyl]chrysen-6-yl]phenyl]pyridine-4-carbonitrile
CID 118398063
2-(7-phenylbenzo[c]carbazol-10-yl)pyridine-4-carbonitrile
CID 118397617
2-[3-[2-(10-phenylphenazin-5-yl)phenyl]phenyl]pyridine-4-carbonitrile
CID 146542824
2-[3-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)phenyl]pyridine-4-carbonitrile
CID 146543164
5-[3-[9-[3-(5-cyano-3-pyridinyl)phenyl]-7-phenylbenzo[c]carbazol-5-yl]phenyl]pyridine-3-carbonitrile
CID 118397718
2-[3-[4-[3-(4-cyano-2-pyridinyl)phenyl]-2,3-diphenylnaphthalen-1-yl]phenyl]pyridine-4-carbonitrile
CID 118397675
2-[3-[3-([1]benzofuro[3,2-b]carbazol-11-yl)phenyl]phenyl]pyridine-4-carbonitrile
CID 146543126
2-[3-[3-([1]benzofuro[2,3-b]carbazol-7-yl)phenyl]phenyl]pyridine-4-carbonitrile
CID 146543626
4-(5,7-diphenylbenzo[g]carbazol-9-yl)pyridine-2-carbonitrile
CID 118397508

Frequently Asked Questions

What is the IUPAC name of 2-[3-(7-phenylbenzo[c]carbazol-5-yl)phenyl]pyridine-4-carbonitrile?
The IUPAC name of 2-[3-(7-phenylbenzo[c]carbazol-5-yl)phenyl]pyridine-4-carbonitrile (CID 118397516) is 2-[3-(7-phenylbenzo[c]carbazol-5-yl)phenyl]pyridine-4-carbonitrile.
What is the SMILES notation for 2-[3-(7-phenylbenzo[c]carbazol-5-yl)phenyl]pyridine-4-carbonitrile?
The canonical SMILES for 2-[3-(7-phenylbenzo[c]carbazol-5-yl)phenyl]pyridine-4-carbonitrile is N#Cc1ccnc(-c2cccc(-c3cc4c(c5ccccc35)c3ccccc3n4-c3ccccc3)c2)c1.
What is the InChIKey of 2-[3-(7-phenylbenzo[c]carbazol-5-yl)phenyl]pyridine-4-carbonitrile?
The InChIKey is JLIHJISYAPEGCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H21N3/c35-22-23-17-18-36-31(19-23)25-10-8-9-24(20-25)30-21-33-34(28-14-5-4-13-27(28)30)29-15-6-7-16-32(29)37(33)26-11-2-1-3-12-26/h1-21H.
What are the key properties of 2-[3-(7-phenylbenzo[c]carbazol-5-yl)phenyl]pyridine-4-carbonitrile?
2-[3-(7-phenylbenzo[c]carbazol-5-yl)phenyl]pyridine-4-carbonitrile has a molecular weight of 471.56 g/mol, XLogP of 8.54, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(7-phenylbenzo[c]carbazol-5-yl)phenyl]pyridine-4-carbonitrile is sourced from PubChem (CID 118397516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).