[4-(4-formamido-1,5-naphthyridin-2-yl)phenyl] thiohypofluorite

C15H10FN3OS — CID 145465272

IUPAC[4-(4-formamido-1,5-naphthyridin-2-yl)phenyl] thiohypofluorite
SMILESO=CNc1cc(-c2ccc(SF)cc2)nc2cccnc12
InChIInChI=1S/C15H10FN3OS/c16-21-11-5-3-10(4-6-11)13-8-14(18-9-20)15-12(19-13)2-1-7-17-15/h1-9H,(H,18,19,20)
InChIKeySBYQWHHGEUIULN-UHFFFAOYSA-N
MW299.33 g/mol
LogP3.84
Rot. Bonds4

About [4-(4-formamido-1,5-naphthyridin-2-yl)phenyl] thiohypofluorite

[4-(4-formamido-1,5-naphthyridin-2-yl)phenyl] thiohypofluorite (PubChem CID 145465272) has the molecular formula C15H10FN3OS and a molecular weight of 299.33 g/mol. Its IUPAC name is [4-(4-formamido-1,5-naphthyridin-2-yl)phenyl] thiohypofluorite.

Molecular Properties

Compound Name[4-(4-formamido-1,5-naphthyridin-2-yl)phenyl] thiohypofluorite
PubChem CID145465272
Molecular FormulaC15H10FN3OS
Molecular Weight299.33 g/mol
Exact Mass299.05
IUPAC Name[4-(4-formamido-1,5-naphthyridin-2-yl)phenyl] thiohypofluorite
SMILESO=CNc1cc(-c2ccc(SF)cc2)nc2cccnc12
InChIInChI=1S/C15H10FN3OS/c16-21-11-5-3-10(4-6-11)13-8-14(18-9-20)15-12(19-13)2-1-7-17-15/h1-9H,(H,18,19,20)
InChIKeySBYQWHHGEUIULN-UHFFFAOYSA-N
XLogP3.84
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.33
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [4-(4-formamido-1,5-naphthyridin-2-yl)phenyl] thiohypofluorite?
The IUPAC name of [4-(4-formamido-1,5-naphthyridin-2-yl)phenyl] thiohypofluorite (CID 145465272) is [4-(4-formamido-1,5-naphthyridin-2-yl)phenyl] thiohypofluorite.
What is the SMILES notation for [4-(4-formamido-1,5-naphthyridin-2-yl)phenyl] thiohypofluorite?
The canonical SMILES for [4-(4-formamido-1,5-naphthyridin-2-yl)phenyl] thiohypofluorite is O=CNc1cc(-c2ccc(SF)cc2)nc2cccnc12.
What is the InChIKey of [4-(4-formamido-1,5-naphthyridin-2-yl)phenyl] thiohypofluorite?
The InChIKey is SBYQWHHGEUIULN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10FN3OS/c16-21-11-5-3-10(4-6-11)13-8-14(18-9-20)15-12(19-13)2-1-7-17-15/h1-9H,(H,18,19,20).
What are the key properties of [4-(4-formamido-1,5-naphthyridin-2-yl)phenyl] thiohypofluorite?
[4-(4-formamido-1,5-naphthyridin-2-yl)phenyl] thiohypofluorite has a molecular weight of 299.33 g/mol, XLogP of 3.84, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(4-formamido-1,5-naphthyridin-2-yl)phenyl] thiohypofluorite is sourced from PubChem (CID 145465272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).