4-(3,5-difluoroanilino)oxolan-3-ol

C10H11F2NO2 — CID 60902051

IUPAC4-(3,5-difluoroanilino)oxolan-3-ol
SMILESOC1COCC1Nc1cc(F)cc(F)c1
InChIInChI=1S/C10H11F2NO2/c11-6-1-7(12)3-8(2-6)13-9-4-15-5-10(9)14/h1-3,9-10,13-14H,4-5H2
InChIKeyZIJNPHJOSHGLQR-UHFFFAOYSA-N
MW215.20 g/mol
LogP1.14
Rot. Bonds2

About 4-(3,5-difluoroanilino)oxolan-3-ol

4-(3,5-difluoroanilino)oxolan-3-ol (PubChem CID 60902051) has the molecular formula C10H11F2NO2 and a molecular weight of 215.20 g/mol. Its IUPAC name is 4-(3,5-difluoroanilino)oxolan-3-ol.

Molecular Properties

Compound Name4-(3,5-difluoroanilino)oxolan-3-ol
PubChem CID60902051
Molecular FormulaC10H11F2NO2
Molecular Weight215.20 g/mol
Exact Mass215.08
IUPAC Name4-(3,5-difluoroanilino)oxolan-3-ol
SMILESOC1COCC1Nc1cc(F)cc(F)c1
InChIInChI=1S/C10H11F2NO2/c11-6-1-7(12)3-8(2-6)13-9-4-15-5-10(9)14/h1-3,9-10,13-14H,4-5H2
InChIKeyZIJNPHJOSHGLQR-UHFFFAOYSA-N
XLogP1.14
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.20
LogP ≤ 51.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(3,5-difluoroanilino)oxolan-3-ol?
The IUPAC name of 4-(3,5-difluoroanilino)oxolan-3-ol (CID 60902051) is 4-(3,5-difluoroanilino)oxolan-3-ol.
What is the SMILES notation for 4-(3,5-difluoroanilino)oxolan-3-ol?
The canonical SMILES for 4-(3,5-difluoroanilino)oxolan-3-ol is OC1COCC1Nc1cc(F)cc(F)c1.
What is the InChIKey of 4-(3,5-difluoroanilino)oxolan-3-ol?
The InChIKey is ZIJNPHJOSHGLQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11F2NO2/c11-6-1-7(12)3-8(2-6)13-9-4-15-5-10(9)14/h1-3,9-10,13-14H,4-5H2.
What are the key properties of 4-(3,5-difluoroanilino)oxolan-3-ol?
4-(3,5-difluoroanilino)oxolan-3-ol has a molecular weight of 215.20 g/mol, XLogP of 1.14, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3,5-difluoroanilino)oxolan-3-ol is sourced from PubChem (CID 60902051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).