2-[2-(sulfinoamino)phenyl]quinoline

C15H12N2O2S — CID 22445092

IUPAC2-[2-(sulfinoamino)phenyl]quinoline
SMILESO=S(O)Nc1ccccc1-c1ccc2ccccc2n1
InChIInChI=1S/C15H12N2O2S/c18-20(19)17-15-8-4-2-6-12(15)14-10-9-11-5-1-3-7-13(11)16-14/h1-10,17H,(H,18,19)
InChIKeySDKQPVIZOAHXEP-UHFFFAOYSA-N
MW284.34 g/mol
LogP3.45
Rot. Bonds3

About 2-[2-(sulfinoamino)phenyl]quinoline

2-[2-(sulfinoamino)phenyl]quinoline (PubChem CID 22445092) has the molecular formula C15H12N2O2S and a molecular weight of 284.34 g/mol. Its IUPAC name is 2-[2-(sulfinoamino)phenyl]quinoline.

Molecular Properties

Compound Name2-[2-(sulfinoamino)phenyl]quinoline
PubChem CID22445092
Molecular FormulaC15H12N2O2S
Molecular Weight284.34 g/mol
Exact Mass284.06
IUPAC Name2-[2-(sulfinoamino)phenyl]quinoline
SMILESO=S(O)Nc1ccccc1-c1ccc2ccccc2n1
InChIInChI=1S/C15H12N2O2S/c18-20(19)17-15-8-4-2-6-12(15)14-10-9-11-5-1-3-7-13(11)16-14/h1-10,17H,(H,18,19)
InChIKeySDKQPVIZOAHXEP-UHFFFAOYSA-N
XLogP3.45
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.34
LogP ≤ 53.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-(dimethylamino)-N-(2-quinolin-2-ylphenyl)benzamide
CID 46376180
2-(2-fluorophenyl)quinoline
CID 11622684
2-(4-quinolin-2-yl-1H-pyrrol-3-yl)quinoline
CID 54524072
3-methyl-N-[2-(6-methylquinolin-2-yl)phenyl]benzenesulfonamide
CID 46376242
diphenyl-(2-quinolin-2-ylphenyl)methanol
CID 156790156
2-(2,5-dimethylphenyl)quinoline
CID 1202732
3-(sulfinoamino)cinnoline
CID 22346485
amino(quinolin-2-yl)methanesulfinic acid
CID 66872593
ethane;2-quinolin-2-ylindene-1,3-dione
CID 123277831
N-[(2-quinolin-2-ylphenyl)methyl]propan-2-amine
CID 116645083
2-[2-(2-methylpropyl)phenyl]quinoline
CID 175803564
2-quinolin-2-ylquinoline-6-carboxylic acid
CID 177243847

Frequently Asked Questions

What is the IUPAC name of 2-[2-(sulfinoamino)phenyl]quinoline?
The IUPAC name of 2-[2-(sulfinoamino)phenyl]quinoline (CID 22445092) is 2-[2-(sulfinoamino)phenyl]quinoline.
What is the SMILES notation for 2-[2-(sulfinoamino)phenyl]quinoline?
The canonical SMILES for 2-[2-(sulfinoamino)phenyl]quinoline is O=S(O)Nc1ccccc1-c1ccc2ccccc2n1.
What is the InChIKey of 2-[2-(sulfinoamino)phenyl]quinoline?
The InChIKey is SDKQPVIZOAHXEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N2O2S/c18-20(19)17-15-8-4-2-6-12(15)14-10-9-11-5-1-3-7-13(11)16-14/h1-10,17H,(H,18,19).
What are the key properties of 2-[2-(sulfinoamino)phenyl]quinoline?
2-[2-(sulfinoamino)phenyl]quinoline has a molecular weight of 284.34 g/mol, XLogP of 3.45, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(sulfinoamino)phenyl]quinoline is sourced from PubChem (CID 22445092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).