9-chloro-5-pyridin-2-ylphenanthridin-6-one

C18H11ClN2O — CID 154707535

IUPAC9-chloro-5-pyridin-2-ylphenanthridin-6-one
SMILESO=c1c2ccc(Cl)cc2c2ccccc2n1-c1ccccn1
InChIInChI=1S/C18H11ClN2O/c19-12-8-9-14-15(11-12)13-5-1-2-6-16(13)21(18(14)22)17-7-3-4-10-20-17/h1-11H
InChIKeyJTMLECMXJXCBLZ-UHFFFAOYSA-N
MW306.75 g/mol
LogP4.19
Rot. Bonds1

About 9-chloro-5-pyridin-2-ylphenanthridin-6-one

9-chloro-5-pyridin-2-ylphenanthridin-6-one (PubChem CID 154707535) has the molecular formula C18H11ClN2O and a molecular weight of 306.75 g/mol. Its IUPAC name is 9-chloro-5-pyridin-2-ylphenanthridin-6-one.

Molecular Properties

Compound Name9-chloro-5-pyridin-2-ylphenanthridin-6-one
PubChem CID154707535
Molecular FormulaC18H11ClN2O
Molecular Weight306.75 g/mol
Exact Mass306.06
IUPAC Name9-chloro-5-pyridin-2-ylphenanthridin-6-one
SMILESO=c1c2ccc(Cl)cc2c2ccccc2n1-c1ccccn1
InChIInChI=1S/C18H11ClN2O/c19-12-8-9-14-15(11-12)13-5-1-2-6-16(13)21(18(14)22)17-7-3-4-10-20-17/h1-11H
InChIKeyJTMLECMXJXCBLZ-UHFFFAOYSA-N
XLogP4.19
TPSA34.89 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.75
LogP ≤ 54.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

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Related Compounds

9-pyridin-2-yl-N-(9-pyridin-2-ylcarbazol-2-yl)carbazol-2-amine
CID 137412781
9-pyridin-2-ylcarbazol-3-amine
CID 135208084
5-pyridin-2-ylbenzimidazolo[2,1-b]quinazolin-12-one
CID 164671964
3,4-bis(4-acetylphenyl)-1-pyridin-2-ylquinolin-2-one
CID 166443047
2,7-dimethyl-9-pyridin-2-ylcarbazole
CID 59557260
2-phenyl-9-(9-pyridin-2-ylcarbazol-2-yl)carbazole
CID 71478701
3-(9-iodocarbazol-3-yl)-9-pyridin-2-ylcarbazole
CID 135198280
9-pyridin-2-yl-2-(2-pyridin-2-ylcarbazol-9-yl)pyrido[2,3-b]indole
CID 155655282
6-chloro-1-pyridin-2-yl-3H-indol-2-one
CID 132570702
9-iodo-5-quinolin-8-ylphenanthridin-6-one
CID 158402058
10-chlorophenanthro[9,10-b]pyrazine
CID 121296750
3,7-diphenyl-5-pyridin-2-ylindolo[2,3-b]carbazole
CID 149342051

Frequently Asked Questions

What is the IUPAC name of 9-chloro-5-pyridin-2-ylphenanthridin-6-one?
The IUPAC name of 9-chloro-5-pyridin-2-ylphenanthridin-6-one (CID 154707535) is 9-chloro-5-pyridin-2-ylphenanthridin-6-one.
What is the SMILES notation for 9-chloro-5-pyridin-2-ylphenanthridin-6-one?
The canonical SMILES for 9-chloro-5-pyridin-2-ylphenanthridin-6-one is O=c1c2ccc(Cl)cc2c2ccccc2n1-c1ccccn1.
What is the InChIKey of 9-chloro-5-pyridin-2-ylphenanthridin-6-one?
The InChIKey is JTMLECMXJXCBLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H11ClN2O/c19-12-8-9-14-15(11-12)13-5-1-2-6-16(13)21(18(14)22)17-7-3-4-10-20-17/h1-11H.
What are the key properties of 9-chloro-5-pyridin-2-ylphenanthridin-6-one?
9-chloro-5-pyridin-2-ylphenanthridin-6-one has a molecular weight of 306.75 g/mol, XLogP of 4.19, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-chloro-5-pyridin-2-ylphenanthridin-6-one is sourced from PubChem (CID 154707535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).