3-phenoxy-2-phenylbenzo[g]quinoline

C25H17NO — CID 168878050

IUPAC3-phenoxy-2-phenylbenzo[g]quinoline
SMILESc1ccc(Oc2cc3cc4ccccc4cc3nc2-c2ccccc2)cc1
InChIInChI=1S/C25H17NO/c1-3-9-18(10-4-1)25-24(27-22-13-5-2-6-14-22)17-21-15-19-11-7-8-12-20(19)16-23(21)26-25/h1-17H
InChIKeyHBIPSXOSFWZHRF-UHFFFAOYSA-N
MW347.42 g/mol
LogP6.85
Rot. Bonds3

About 3-phenoxy-2-phenylbenzo[g]quinoline

3-phenoxy-2-phenylbenzo[g]quinoline (PubChem CID 168878050) has the molecular formula C25H17NO and a molecular weight of 347.42 g/mol. Its IUPAC name is 3-phenoxy-2-phenylbenzo[g]quinoline.

Molecular Properties

Compound Name3-phenoxy-2-phenylbenzo[g]quinoline
PubChem CID168878050
Molecular FormulaC25H17NO
Molecular Weight347.42 g/mol
Exact Mass347.13
IUPAC Name3-phenoxy-2-phenylbenzo[g]quinoline
SMILESc1ccc(Oc2cc3cc4ccccc4cc3nc2-c2ccccc2)cc1
InChIInChI=1S/C25H17NO/c1-3-9-18(10-4-1)25-24(27-22-13-5-2-6-14-22)17-21-15-19-11-7-8-12-20(19)16-23(21)26-25/h1-17H
InChIKeyHBIPSXOSFWZHRF-UHFFFAOYSA-N
XLogP6.85
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500347.42
LogP ≤ 56.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Related Compounds

2-phenyl-3-(2-phenylquinolin-3-yl)oxyquinoline
CID 175690294
2-phenylbenzo[g]quinoline
CID 45113076
2,3-bis(4-methoxyphenyl)naphtho[2,3-g]quinoxaline;methane
CID 145053980
3-bromo-4-phenoxy-2-phenylquinoline
CID 164676381
2,3-bis(4-methoxyphenyl)naphtho[2,3-g]quinoxaline
CID 121258930
benzo[b]acridine
CID 6451416
6,7-dimethoxy-2,3-diphenylquinoxaline
CID 1236458
4,5,10,11,16,17-hexakis(4-phenoxyphenyl)-3,6,9,12,15,18-hexazatetracyclo[12.4.0.02,7.08,13]octadeca-1,3,5,7,9,11,13,15,17-nonaene
CID 86035796
2-chloro-5-phenoxy-4,6-diphenylpyrimidine
CID 13327262
iridium;3-methyl-2-phenylquinoline
CID 174474394
N,N-diethyl-6,7-dimethoxy-3-phenoxyquinolin-2-amine
CID 134913603
1,3-diphenoxy-2-phenylbenzene
CID 88611434

Frequently Asked Questions

What is the IUPAC name of 3-phenoxy-2-phenylbenzo[g]quinoline?
The IUPAC name of 3-phenoxy-2-phenylbenzo[g]quinoline (CID 168878050) is 3-phenoxy-2-phenylbenzo[g]quinoline.
What is the SMILES notation for 3-phenoxy-2-phenylbenzo[g]quinoline?
The canonical SMILES for 3-phenoxy-2-phenylbenzo[g]quinoline is c1ccc(Oc2cc3cc4ccccc4cc3nc2-c2ccccc2)cc1.
What is the InChIKey of 3-phenoxy-2-phenylbenzo[g]quinoline?
The InChIKey is HBIPSXOSFWZHRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H17NO/c1-3-9-18(10-4-1)25-24(27-22-13-5-2-6-14-22)17-21-15-19-11-7-8-12-20(19)16-23(21)26-25/h1-17H.
What are the key properties of 3-phenoxy-2-phenylbenzo[g]quinoline?
3-phenoxy-2-phenylbenzo[g]quinoline has a molecular weight of 347.42 g/mol, XLogP of 6.85, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-phenoxy-2-phenylbenzo[g]quinoline is sourced from PubChem (CID 168878050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).