5-(2-phenothiazin-10-ylphenyl)pyridine-2-carbonitrile

C24H15N3S — CID 146538293

IUPAC5-(2-phenothiazin-10-ylphenyl)pyridine-2-carbonitrile
SMILESN#Cc1ccc(-c2ccccc2N2c3ccccc3Sc3ccccc32)cn1
InChIInChI=1S/C24H15N3S/c25-15-18-14-13-17(16-26-18)19-7-1-2-8-20(19)27-21-9-3-5-11-23(21)28-24-12-6-4-10-22(24)27/h1-14,16H
InChIKeyGVYDKZZPBZGYFO-UHFFFAOYSA-N
MW377.47 g/mol
LogP6.55
Rot. Bonds2

About 5-(2-phenothiazin-10-ylphenyl)pyridine-2-carbonitrile

5-(2-phenothiazin-10-ylphenyl)pyridine-2-carbonitrile (PubChem CID 146538293) has the molecular formula C24H15N3S and a molecular weight of 377.47 g/mol. Its IUPAC name is 5-(2-phenothiazin-10-ylphenyl)pyridine-2-carbonitrile.

Molecular Properties

Compound Name5-(2-phenothiazin-10-ylphenyl)pyridine-2-carbonitrile
PubChem CID146538293
Molecular FormulaC24H15N3S
Molecular Weight377.47 g/mol
Exact Mass377.10
IUPAC Name5-(2-phenothiazin-10-ylphenyl)pyridine-2-carbonitrile
SMILESN#Cc1ccc(-c2ccccc2N2c3ccccc3Sc3ccccc32)cn1
InChIInChI=1S/C24H15N3S/c25-15-18-14-13-17(16-26-18)19-7-1-2-8-20(19)27-21-9-3-5-11-23(21)28-24-12-6-4-10-22(24)27/h1-14,16H
InChIKeyGVYDKZZPBZGYFO-UHFFFAOYSA-N
XLogP6.55
TPSA39.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500377.47
LogP ≤ 56.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

5-[2-(10-phenylphenazin-5-yl)phenyl]pyridine-2-carbonitrile
CID 146543497
4-[2-(2-phenothiazin-10-ylphenyl)phenyl]pyridine-3-carbonitrile
CID 146543457
5-[3-[2-(9,9-dimethylacridin-10-yl)phenyl]phenyl]pyridine-2-carbonitrile
CID 146543342
2-[4-(3-phenothiazin-10-ylphenyl)phenyl]pyridine-3-carbonitrile;2-[4-(3-phenothiazin-10-ylphenyl)phenyl]pyridine-4-carbonitrile;3-[4-(3-phenothiazin-10-ylphenyl)phenyl]pyridine-2-carbonitrile;5-[4-(3-phenothiazin-10-ylphenyl)phenyl]pyridine-2-carbonitrile
CID 160825245
4-(3-phenothiazin-10-ylphenyl)pyridine-2-carbonitrile
CID 146542786
5-[6-(2-carbazol-9-ylphenyl)-2-pyridinyl]pyridine-2-carbonitrile
CID 146542879
3-[3-(3-phenothiazin-10-ylphenyl)phenyl]pyridine-2-carbonitrile
CID 146542766
4-(6-spiro[benzo[b][1,4]benzothiazepine-6,9'-fluorene]-5-yl-3-pyridinyl)benzonitrile
CID 163875921
3-[2-[3,7-di(phenothiazin-10-yl)phenothiazin-10-yl]phenyl]benzene-1,2-dicarbonitrile
CID 122435681
10-[2-chloro-5-(2-fluorophenyl)-3-phenothiazin-10-ylphenyl]phenothiazine
CID 167061733
4,6-difluoro-2-phenothiazin-10-ylpyrimidine-5-carbonitrile
CID 146669264
10-[4-[4-[3-(4-phenothiazin-10-ylphenyl)-4-pyridinyl]-3-pyridinyl]phenyl]phenothiazine
CID 122433873

Frequently Asked Questions

What is the IUPAC name of 5-(2-phenothiazin-10-ylphenyl)pyridine-2-carbonitrile?
The IUPAC name of 5-(2-phenothiazin-10-ylphenyl)pyridine-2-carbonitrile (CID 146538293) is 5-(2-phenothiazin-10-ylphenyl)pyridine-2-carbonitrile.
What is the SMILES notation for 5-(2-phenothiazin-10-ylphenyl)pyridine-2-carbonitrile?
The canonical SMILES for 5-(2-phenothiazin-10-ylphenyl)pyridine-2-carbonitrile is N#Cc1ccc(-c2ccccc2N2c3ccccc3Sc3ccccc32)cn1.
What is the InChIKey of 5-(2-phenothiazin-10-ylphenyl)pyridine-2-carbonitrile?
The InChIKey is GVYDKZZPBZGYFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H15N3S/c25-15-18-14-13-17(16-26-18)19-7-1-2-8-20(19)27-21-9-3-5-11-23(21)28-24-12-6-4-10-22(24)27/h1-14,16H.
What are the key properties of 5-(2-phenothiazin-10-ylphenyl)pyridine-2-carbonitrile?
5-(2-phenothiazin-10-ylphenyl)pyridine-2-carbonitrile has a molecular weight of 377.47 g/mol, XLogP of 6.55, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-phenothiazin-10-ylphenyl)pyridine-2-carbonitrile is sourced from PubChem (CID 146538293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).