6-[6-(3-chlorophenyl)-2-pyridinyl]phenanthridine

C24H15ClN2 — CID 171832740

IUPAC6-[6-(3-chlorophenyl)-2-pyridinyl]phenanthridine
SMILESClc1cccc(-c2cccc(-c3nc4ccccc4c4ccccc34)n2)c1
InChIInChI=1S/C24H15ClN2/c25-17-8-5-7-16(15-17)21-13-6-14-23(26-21)24-20-11-2-1-9-18(20)19-10-3-4-12-22(19)27-24/h1-15H
InChIKeyPMTDJVLDPUBZKS-UHFFFAOYSA-N
MW366.85 g/mol
LogP6.77
Rot. Bonds2

About 6-[6-(3-chlorophenyl)-2-pyridinyl]phenanthridine

6-[6-(3-chlorophenyl)-2-pyridinyl]phenanthridine (PubChem CID 171832740) has the molecular formula C24H15ClN2 and a molecular weight of 366.85 g/mol. Its IUPAC name is 6-[6-(3-chlorophenyl)-2-pyridinyl]phenanthridine.

Molecular Properties

Compound Name6-[6-(3-chlorophenyl)-2-pyridinyl]phenanthridine
PubChem CID171832740
Molecular FormulaC24H15ClN2
Molecular Weight366.85 g/mol
Exact Mass366.09
IUPAC Name6-[6-(3-chlorophenyl)-2-pyridinyl]phenanthridine
SMILESClc1cccc(-c2cccc(-c3nc4ccccc4c4ccccc34)n2)c1
InChIInChI=1S/C24H15ClN2/c25-17-8-5-7-16(15-17)21-13-6-14-23(26-21)24-20-11-2-1-9-18(20)19-10-3-4-12-22(19)27-24/h1-15H
InChIKeyPMTDJVLDPUBZKS-UHFFFAOYSA-N
XLogP6.77
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500366.85
LogP ≤ 56.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-[4-(6-phenanthridin-6-yl-2-pyridinyl)phenyl]-9-phenyl-1,10-phenanthroline
CID 171832717
6-[6-[3-[3-[4-phenyl-6-(4-pyridin-3-ylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]-2-pyridinyl]phenanthridine
CID 176818932
3-bromo-2-(3-chlorophenyl)-4-methylquinoline
CID 29301768
2-(3-chlorophenyl)-4-naphthalen-1-ylquinazoline
CID 139365483
6-[6-[2-[4-phenyl-6-(4-pyridin-3-ylphenyl)-1,3,5-triazin-2-yl]-4-pyridinyl]-2-pyridinyl]phenanthridine
CID 176819163
6-(3-chlorophenyl)pyridin-2-amine
CID 61230327
3-[2-(3-chlorophenyl)quinolin-4-yl]propanoic acid;hydrochloride
CID 170330550
6-[6-(8-phenyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)-2-pyridinyl]phenanthridine
CID 176819051
1-chloro-3-(2-phenylphenyl)benzene
CID 69293962
5-(3-chlorophenyl)-4-azahexacyclo[12.12.0.02,7.08,13.015,20.021,26]hexacosa-1(14),2,4,6,8,10,12,15,17,19,21,23,25-tridecaene
CID 146641814
6-[3-[4-(3-phenanthridin-6-ylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenanthridine
CID 129265621
4-(3-chlorophenyl)-2-(5-methoxy-6-methyl-2-pyridinyl)quinazoline
CID 67701962

Frequently Asked Questions

What is the IUPAC name of 6-[6-(3-chlorophenyl)-2-pyridinyl]phenanthridine?
The IUPAC name of 6-[6-(3-chlorophenyl)-2-pyridinyl]phenanthridine (CID 171832740) is 6-[6-(3-chlorophenyl)-2-pyridinyl]phenanthridine.
What is the SMILES notation for 6-[6-(3-chlorophenyl)-2-pyridinyl]phenanthridine?
The canonical SMILES for 6-[6-(3-chlorophenyl)-2-pyridinyl]phenanthridine is Clc1cccc(-c2cccc(-c3nc4ccccc4c4ccccc34)n2)c1.
What is the InChIKey of 6-[6-(3-chlorophenyl)-2-pyridinyl]phenanthridine?
The InChIKey is PMTDJVLDPUBZKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H15ClN2/c25-17-8-5-7-16(15-17)21-13-6-14-23(26-21)24-20-11-2-1-9-18(20)19-10-3-4-12-22(19)27-24/h1-15H.
What are the key properties of 6-[6-(3-chlorophenyl)-2-pyridinyl]phenanthridine?
6-[6-(3-chlorophenyl)-2-pyridinyl]phenanthridine has a molecular weight of 366.85 g/mol, XLogP of 6.77, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[6-(3-chlorophenyl)-2-pyridinyl]phenanthridine is sourced from PubChem (CID 171832740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).