7-fluoro-5-propan-2-yloxy-1,3-dihydroindol-2-one

C11H12FNO2 — CID 71144685

IUPAC7-fluoro-5-propan-2-yloxy-1,3-dihydroindol-2-one
SMILESCC(C)Oc1cc(F)c2c(c1)CC(=O)N2
InChIInChI=1S/C11H12FNO2/c1-6(2)15-8-3-7-4-10(14)13-11(7)9(12)5-8/h3,5-6H,4H2,1-2H3,(H,13,14)
InChIKeyZHIKGJWSHXFFDE-UHFFFAOYSA-N
MW209.22 g/mol
LogP2.11
Rot. Bonds2

About 7-fluoro-5-propan-2-yloxy-1,3-dihydroindol-2-one

7-fluoro-5-propan-2-yloxy-1,3-dihydroindol-2-one (PubChem CID 71144685) has the molecular formula C11H12FNO2 and a molecular weight of 209.22 g/mol. Its IUPAC name is 7-fluoro-5-propan-2-yloxy-1,3-dihydroindol-2-one.

Molecular Properties

Compound Name7-fluoro-5-propan-2-yloxy-1,3-dihydroindol-2-one
PubChem CID71144685
Molecular FormulaC11H12FNO2
Molecular Weight209.22 g/mol
Exact Mass209.09
IUPAC Name7-fluoro-5-propan-2-yloxy-1,3-dihydroindol-2-one
SMILESCC(C)Oc1cc(F)c2c(c1)CC(=O)N2
InChIInChI=1S/C11H12FNO2/c1-6(2)15-8-3-7-4-10(14)13-11(7)9(12)5-8/h3,5-6H,4H2,1-2H3,(H,13,14)
InChIKeyZHIKGJWSHXFFDE-UHFFFAOYSA-N
XLogP2.11
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.22
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-fluoro-5-propan-2-yloxy-1,3-dihydroindol-2-one?
The IUPAC name of 7-fluoro-5-propan-2-yloxy-1,3-dihydroindol-2-one (CID 71144685) is 7-fluoro-5-propan-2-yloxy-1,3-dihydroindol-2-one.
What is the SMILES notation for 7-fluoro-5-propan-2-yloxy-1,3-dihydroindol-2-one?
The canonical SMILES for 7-fluoro-5-propan-2-yloxy-1,3-dihydroindol-2-one is CC(C)Oc1cc(F)c2c(c1)CC(=O)N2.
What is the InChIKey of 7-fluoro-5-propan-2-yloxy-1,3-dihydroindol-2-one?
The InChIKey is ZHIKGJWSHXFFDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12FNO2/c1-6(2)15-8-3-7-4-10(14)13-11(7)9(12)5-8/h3,5-6H,4H2,1-2H3,(H,13,14).
What are the key properties of 7-fluoro-5-propan-2-yloxy-1,3-dihydroindol-2-one?
7-fluoro-5-propan-2-yloxy-1,3-dihydroindol-2-one has a molecular weight of 209.22 g/mol, XLogP of 2.11, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-fluoro-5-propan-2-yloxy-1,3-dihydroindol-2-one is sourced from PubChem (CID 71144685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).