8-phenyl-2-(sulfinoamino)quinoline

C15H12N2O2S — CID 174322817

IUPAC8-phenyl-2-(sulfinoamino)quinoline
SMILESO=S(O)Nc1ccc2cccc(-c3ccccc3)c2n1
InChIInChI=1S/C15H12N2O2S/c18-20(19)17-14-10-9-12-7-4-8-13(15(12)16-14)11-5-2-1-3-6-11/h1-10H,(H,16,17)(H,18,19)
InChIKeyJYTGXHQHZDGXIL-UHFFFAOYSA-N
MW284.34 g/mol
LogP3.45
Rot. Bonds3

About 8-phenyl-2-(sulfinoamino)quinoline

8-phenyl-2-(sulfinoamino)quinoline (PubChem CID 174322817) has the molecular formula C15H12N2O2S and a molecular weight of 284.34 g/mol. Its IUPAC name is 8-phenyl-2-(sulfinoamino)quinoline.

Molecular Properties

Compound Name8-phenyl-2-(sulfinoamino)quinoline
PubChem CID174322817
Molecular FormulaC15H12N2O2S
Molecular Weight284.34 g/mol
Exact Mass284.06
IUPAC Name8-phenyl-2-(sulfinoamino)quinoline
SMILESO=S(O)Nc1ccc2cccc(-c3ccccc3)c2n1
InChIInChI=1S/C15H12N2O2S/c18-20(19)17-14-10-9-12-7-4-8-13(15(12)16-14)11-5-2-1-3-6-11/h1-10H,(H,16,17)(H,18,19)
InChIKeyJYTGXHQHZDGXIL-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

8-phenyl-2-(sulfinatoamino)quinoline;zinc
CID 174322816
8-phenyl-2-sulfanyloxyquinoline
CID 175194288
mercury;8-phenylquinoline;hydrate
CID 174770535
sodium;hydride;8-phenylnaphthalene-2-sulfinic acid
CID 173441375
2-[2-(sulfinoamino)phenyl]quinoline
CID 22445092
3-phenylbenzene-1,2-diol;sulfurous acid
CID 174366785
(8-phenylnaphthalen-1-yl) sulfite
CID 175356510
N-[2-(dimethylamino)ethyl]-5-phenylacridine-4-carboxamide
CID 10690459
(3-ethyl-8-phenylquinolin-2-yl)hydrazine
CID 63524029
2-[(8-hydroxyquinolin-2-yl)amino]propanoic acid
CID 174996236
3-ethyl-8-phenylquinolin-2-amine
CID 55175955
2-methylquinolin-8-ol;2-phenylphenol;propane
CID 143547724

Frequently Asked Questions

What is the IUPAC name of 8-phenyl-2-(sulfinoamino)quinoline?
The IUPAC name of 8-phenyl-2-(sulfinoamino)quinoline (CID 174322817) is 8-phenyl-2-(sulfinoamino)quinoline.
What is the SMILES notation for 8-phenyl-2-(sulfinoamino)quinoline?
The canonical SMILES for 8-phenyl-2-(sulfinoamino)quinoline is O=S(O)Nc1ccc2cccc(-c3ccccc3)c2n1.
What is the InChIKey of 8-phenyl-2-(sulfinoamino)quinoline?
The InChIKey is JYTGXHQHZDGXIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N2O2S/c18-20(19)17-14-10-9-12-7-4-8-13(15(12)16-14)11-5-2-1-3-6-11/h1-10H,(H,16,17)(H,18,19).
What are the key properties of 8-phenyl-2-(sulfinoamino)quinoline?
8-phenyl-2-(sulfinoamino)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 8-phenyl-2-(sulfinoamino)quinoline is sourced from PubChem (CID 174322817), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).