2-[3-(2-phenoxazin-10-ylphenyl)phenyl]pyridine-4-carbonitrile

C30H19N3O — CID 146542742

IUPAC2-[3-(2-phenoxazin-10-ylphenyl)phenyl]pyridine-4-carbonitrile
SMILESN#Cc1ccnc(-c2cccc(-c3ccccc3N3c4ccccc4Oc4ccccc43)c2)c1
InChIInChI=1S/C30H19N3O/c31-20-21-16-17-32-25(18-21)23-9-7-8-22(19-23)24-10-1-2-11-26(24)33-27-12-3-5-14-29(27)34-30-15-6-4-13-28(30)33/h1-19H
InChIKeyBPEALWLYOOGGIJ-UHFFFAOYSA-N
MW437.50 g/mol
LogP7.86
Rot. Bonds3

About 2-[3-(2-phenoxazin-10-ylphenyl)phenyl]pyridine-4-carbonitrile

2-[3-(2-phenoxazin-10-ylphenyl)phenyl]pyridine-4-carbonitrile (PubChem CID 146542742) has the molecular formula C30H19N3O and a molecular weight of 437.50 g/mol. Its IUPAC name is 2-[3-(2-phenoxazin-10-ylphenyl)phenyl]pyridine-4-carbonitrile.

Molecular Properties

Compound Name2-[3-(2-phenoxazin-10-ylphenyl)phenyl]pyridine-4-carbonitrile
PubChem CID146542742
Molecular FormulaC30H19N3O
Molecular Weight437.50 g/mol
Exact Mass437.15
IUPAC Name2-[3-(2-phenoxazin-10-ylphenyl)phenyl]pyridine-4-carbonitrile
SMILESN#Cc1ccnc(-c2cccc(-c3ccccc3N3c4ccccc4Oc4ccccc43)c2)c1
InChIInChI=1S/C30H19N3O/c31-20-21-16-17-32-25(18-21)23-9-7-8-22(19-23)24-10-1-2-11-26(24)33-27-12-3-5-14-29(27)34-30-15-6-4-13-28(30)33/h1-19H
InChIKeyBPEALWLYOOGGIJ-UHFFFAOYSA-N
XLogP7.86
TPSA49.15 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500437.50
LogP ≤ 57.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-[3-[2-(10-phenylphenazin-5-yl)phenyl]phenyl]pyridine-4-carbonitrile
CID 146542824
2-[3-(2-carbazol-9-ylphenyl)phenyl]pyridine-4-carbonitrile
CID 146543414
3-[3-(2-phenoxazin-10-ylphenyl)phenyl]pyridine-4-carbonitrile
CID 146543305
2-[3-[12-[3-(4-cyano-2-pyridinyl)phenyl]chrysen-6-yl]phenyl]pyridine-4-carbonitrile
CID 118398063
3-[3-[4,6-bis[4-(3-cyanophenyl)-2-phenoxazin-10-ylphenyl]-1,3,5-triazin-2-yl]phenyl]benzonitrile
CID 170133824
2-[4-[4-[4-(2-cyanophenyl)-2-phenoxazin-10-ylphenyl]-6-[4-(3-cyanophenyl)phenyl]-1,3,5-triazin-2-yl]-3-phenoxazin-10-ylphenyl]benzonitrile
CID 163742751
2-(3-phenoxazin-10-ylphenyl)pyridine-3-carbonitrile;2-(3-phenoxazin-10-ylphenyl)pyridine-4-carbonitrile;4-(3-phenoxazin-10-ylphenyl)pyridine-2-carbonitrile;4-(3-phenoxazin-10-ylphenyl)pyridine-3-carbonitrile;5-(3-phenoxazin-10-ylphenyl)pyridine-2-carbonitrile
CID 162265903
5-[2-(2-phenoxazin-10-ylphenyl)phenyl]pyridine-3-carbonitrile
CID 146542731
3-[5-(3-cyanophenyl)-3-methyl-2,4-di(phenoxazin-10-yl)phenyl]benzonitrile
CID 139553033
6-[3-[2-(10-phenylphenazin-5-yl)phenyl]phenyl]pyridine-3-carbonitrile
CID 146543496
2-[3-[4-[3-(4-cyano-2-pyridinyl)phenyl]-2,3-diphenylnaphthalen-1-yl]phenyl]pyridine-4-carbonitrile
CID 118397675
2,6-bis(4-phenoxazin-10-ylphenyl)pyridine-4-carbonitrile
CID 155034855

Frequently Asked Questions

What is the IUPAC name of 2-[3-(2-phenoxazin-10-ylphenyl)phenyl]pyridine-4-carbonitrile?
The IUPAC name of 2-[3-(2-phenoxazin-10-ylphenyl)phenyl]pyridine-4-carbonitrile (CID 146542742) is 2-[3-(2-phenoxazin-10-ylphenyl)phenyl]pyridine-4-carbonitrile.
What is the SMILES notation for 2-[3-(2-phenoxazin-10-ylphenyl)phenyl]pyridine-4-carbonitrile?
The canonical SMILES for 2-[3-(2-phenoxazin-10-ylphenyl)phenyl]pyridine-4-carbonitrile is N#Cc1ccnc(-c2cccc(-c3ccccc3N3c4ccccc4Oc4ccccc43)c2)c1.
What is the InChIKey of 2-[3-(2-phenoxazin-10-ylphenyl)phenyl]pyridine-4-carbonitrile?
The InChIKey is BPEALWLYOOGGIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H19N3O/c31-20-21-16-17-32-25(18-21)23-9-7-8-22(19-23)24-10-1-2-11-26(24)33-27-12-3-5-14-29(27)34-30-15-6-4-13-28(30)33/h1-19H.
What are the key properties of 2-[3-(2-phenoxazin-10-ylphenyl)phenyl]pyridine-4-carbonitrile?
2-[3-(2-phenoxazin-10-ylphenyl)phenyl]pyridine-4-carbonitrile has a molecular weight of 437.50 g/mol, XLogP of 7.86, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(2-phenoxazin-10-ylphenyl)phenyl]pyridine-4-carbonitrile is sourced from PubChem (CID 146542742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).