10-fluoro-2-methoxy-[1]benzothiolo[2,3-c]quinoline

C16H10FNOS — CID 91824507

IUPAC10-fluoro-2-methoxy-[1]benzothiolo[2,3-c]quinoline
SMILESCOc1ccc2ncc3sc4ccc(F)cc4c3c2c1
InChIInChI=1S/C16H10FNOS/c1-19-10-3-4-13-11(7-10)16-12-6-9(17)2-5-14(12)20-15(16)8-18-13/h2-8H,1H3
InChIKeyNLKAHEYMPMUROE-UHFFFAOYSA-N
MW283.33 g/mol
LogP4.75
Rot. Bonds1

About 10-fluoro-2-methoxy-[1]benzothiolo[2,3-c]quinoline

10-fluoro-2-methoxy-[1]benzothiolo[2,3-c]quinoline (PubChem CID 91824507) has the molecular formula C16H10FNOS and a molecular weight of 283.33 g/mol. Its IUPAC name is 10-fluoro-2-methoxy-[1]benzothiolo[2,3-c]quinoline.

Molecular Properties

Compound Name10-fluoro-2-methoxy-[1]benzothiolo[2,3-c]quinoline
PubChem CID91824507
Molecular FormulaC16H10FNOS
Molecular Weight283.33 g/mol
Exact Mass283.05
IUPAC Name10-fluoro-2-methoxy-[1]benzothiolo[2,3-c]quinoline
SMILESCOc1ccc2ncc3sc4ccc(F)cc4c3c2c1
InChIInChI=1S/C16H10FNOS/c1-19-10-3-4-13-11(7-10)16-12-6-9(17)2-5-14(12)20-15(16)8-18-13/h2-8H,1H3
InChIKeyNLKAHEYMPMUROE-UHFFFAOYSA-N
XLogP4.75
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.33
LogP ≤ 54.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 10-fluoro-2-methoxy-[1]benzothiolo[2,3-c]quinoline?
The IUPAC name of 10-fluoro-2-methoxy-[1]benzothiolo[2,3-c]quinoline (CID 91824507) is 10-fluoro-2-methoxy-[1]benzothiolo[2,3-c]quinoline.
What is the SMILES notation for 10-fluoro-2-methoxy-[1]benzothiolo[2,3-c]quinoline?
The canonical SMILES for 10-fluoro-2-methoxy-[1]benzothiolo[2,3-c]quinoline is COc1ccc2ncc3sc4ccc(F)cc4c3c2c1.
What is the InChIKey of 10-fluoro-2-methoxy-[1]benzothiolo[2,3-c]quinoline?
The InChIKey is NLKAHEYMPMUROE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10FNOS/c1-19-10-3-4-13-11(7-10)16-12-6-9(17)2-5-14(12)20-15(16)8-18-13/h2-8H,1H3.
What are the key properties of 10-fluoro-2-methoxy-[1]benzothiolo[2,3-c]quinoline?
10-fluoro-2-methoxy-[1]benzothiolo[2,3-c]quinoline has a molecular weight of 283.33 g/mol, XLogP of 4.75, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 10-fluoro-2-methoxy-[1]benzothiolo[2,3-c]quinoline is sourced from PubChem (CID 91824507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).