2-(3-phenylphenyl)-1,10-phenanthroline

C24H16N2 — CID 118188250

IUPAC2-(3-phenylphenyl)-1,10-phenanthroline
SMILESc1ccc(-c2cccc(-c3ccc4ccc5cccnc5c4n3)c2)cc1
InChIInChI=1S/C24H16N2/c1-2-6-17(7-3-1)20-8-4-9-21(16-20)22-14-13-19-12-11-18-10-5-15-25-23(18)24(19)26-22/h1-16H
InChIKeyIOHGLMBEEWQNDE-UHFFFAOYSA-N
MW332.41 g/mol
LogP6.12
Rot. Bonds2

About 2-(3-phenylphenyl)-1,10-phenanthroline

2-(3-phenylphenyl)-1,10-phenanthroline (PubChem CID 118188250) has the molecular formula C24H16N2 and a molecular weight of 332.41 g/mol. Its IUPAC name is 2-(3-phenylphenyl)-1,10-phenanthroline.

Molecular Properties

Compound Name2-(3-phenylphenyl)-1,10-phenanthroline
PubChem CID118188250
Molecular FormulaC24H16N2
Molecular Weight332.41 g/mol
Exact Mass332.13
IUPAC Name2-(3-phenylphenyl)-1,10-phenanthroline
SMILESc1ccc(-c2cccc(-c3ccc4ccc5cccnc5c4n3)c2)cc1
InChIInChI=1S/C24H16N2/c1-2-6-17(7-3-1)20-8-4-9-21(16-20)22-14-13-19-12-11-18-10-5-15-25-23(18)24(19)26-22/h1-16H
InChIKeyIOHGLMBEEWQNDE-UHFFFAOYSA-N
XLogP6.12
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500332.41
LogP ≤ 56.12
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-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-5-phenylphenyl]-1,10-phenanthroline
CID 142752628
2-[3-[7-(2-phenylquinolin-7-yl)quinolin-2-yl]phenyl]-1,10-phenanthroline
CID 155023081
2-[3-[10-(4-phenylphenyl)anthracen-9-yl]phenyl]-1,10-phenanthroline
CID 121460929
2-methyl-9-[4-(9-methyl-1,10-phenanthrolin-2-yl)phenyl]-1,10-phenanthroline;2-[3-[3-(1,10-phenanthrolin-2-yl)phenyl]phenyl]-1,10-phenanthroline;2-phenyl-9-[3-(9-phenyl-1,10-phenanthrolin-2-yl)phenyl]-1,10-phenanthroline
CID 159054381
2-[3-(2,3,5,6-tetraphenyl-4-pyridinyl)phenyl]-1,10-phenanthroline
CID 167363724
2-[2,6-bis(4-phenylphenyl)-4-pyridinyl]-1,10-phenanthroline
CID 146474012
2-[3-methyl-5-(1,10-phenanthrolin-2-yl)phenyl]-9-[3-(1,10-phenanthrolin-2-yl)phenyl]-1,10-phenanthroline
CID 144635240
2-phenyl-9-[3-[4-[3-phenyl-5-(4-phenylphenyl)phenyl]phenyl]phenyl]-1,10-phenanthroline
CID 138725055
2-phenyl-9-[3-[3-phenyl-5-(4-phenylphenyl)phenyl]phenyl]-1,10-phenanthroline
CID 138725062
2-phenyl-9-[4-[3-[4-(9-phenyl-1,10-phenanthrolin-2-yl)phenyl]phenyl]phenyl]-1,10-phenanthroline
CID 59010455
2-phenyl-9-[3-[2-(2-quinolin-3-ylquinolin-7-yl)quinolin-7-yl]phenyl]-1,10-phenanthroline;2-[4-[2-(2-quinolin-3-ylquinolin-7-yl)quinolin-7-yl]phenyl]-1,10-phenanthroline
CID 165080275
22-(3-pyridin-2-ylphenyl)-52,55-diazatridecacyclo[41.8.4.22,5.211,14.230,33.239,42.16,10.115,19.120,24.125,29.134,38.046,54.049,53]octahexaconta-1(52),2(68),3,5(67),6,8,10(66),11(65),12,14(64),15(63),16,18,20(62),21,23,25,27,29(61),30,32,34(58),35,37,39,41,43(55),44,46(54),47,49(53),50,56,59-tetratriacontaene
CID 140920150

Frequently Asked Questions

What is the IUPAC name of 2-(3-phenylphenyl)-1,10-phenanthroline?
The IUPAC name of 2-(3-phenylphenyl)-1,10-phenanthroline (CID 118188250) is 2-(3-phenylphenyl)-1,10-phenanthroline.
What is the SMILES notation for 2-(3-phenylphenyl)-1,10-phenanthroline?
The canonical SMILES for 2-(3-phenylphenyl)-1,10-phenanthroline is c1ccc(-c2cccc(-c3ccc4ccc5cccnc5c4n3)c2)cc1.
What is the InChIKey of 2-(3-phenylphenyl)-1,10-phenanthroline?
The InChIKey is IOHGLMBEEWQNDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H16N2/c1-2-6-17(7-3-1)20-8-4-9-21(16-20)22-14-13-19-12-11-18-10-5-15-25-23(18)24(19)26-22/h1-16H.
What are the key properties of 2-(3-phenylphenyl)-1,10-phenanthroline?
2-(3-phenylphenyl)-1,10-phenanthroline has a molecular weight of 332.41 g/mol, XLogP of 6.12, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-phenylphenyl)-1,10-phenanthroline is sourced from PubChem (CID 118188250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).