4-(3-fluoroanilino)oxolan-3-ol

C10H12FNO2 — CID 60896820

IUPAC4-(3-fluoroanilino)oxolan-3-ol
SMILESOC1COCC1Nc1cccc(F)c1
InChIInChI=1S/C10H12FNO2/c11-7-2-1-3-8(4-7)12-9-5-14-6-10(9)13/h1-4,9-10,12-13H,5-6H2
InChIKeyIHVBLEKVRFRKKG-UHFFFAOYSA-N
MW197.21 g/mol
LogP1.00
Rot. Bonds2

About 4-(3-fluoroanilino)oxolan-3-ol

4-(3-fluoroanilino)oxolan-3-ol (PubChem CID 60896820) has the molecular formula C10H12FNO2 and a molecular weight of 197.21 g/mol. Its IUPAC name is 4-(3-fluoroanilino)oxolan-3-ol.

Molecular Properties

Compound Name4-(3-fluoroanilino)oxolan-3-ol
PubChem CID60896820
Molecular FormulaC10H12FNO2
Molecular Weight197.21 g/mol
Exact Mass197.09
IUPAC Name4-(3-fluoroanilino)oxolan-3-ol
SMILESOC1COCC1Nc1cccc(F)c1
InChIInChI=1S/C10H12FNO2/c11-7-2-1-3-8(4-7)12-9-5-14-6-10(9)13/h1-4,9-10,12-13H,5-6H2
InChIKeyIHVBLEKVRFRKKG-UHFFFAOYSA-N
XLogP1.00
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.21
LogP ≤ 51.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-(3,5-difluoroanilino)oxolan-3-ol
CID 60902051
(3S,4R)-4-anilinooxolan-3-ol
CID 93383619
4-(3-ethylanilino)oxolan-3-ol
CID 60902246
trans-(1R,2R)-2-(3-fluoroanilino)cyclopentan-1-ol
CID 93345851
4-[3-(trifluoromethoxy)anilino]oxolan-3-ol
CID 60899392
(2R,3S)-N-(3-fluorophenyl)-2-methyloxolan-3-amine
CID 97358489
N-(3-fluorophenyl)-4-(methylamino)oxolane-3-carboxamide
CID 66267926
4-[(4-hydroxyoxolan-3-yl)amino]benzene-1,2-dicarbonitrile
CID 107789252
4-(2,6-dibromoanilino)oxolan-3-ol
CID 107598854
2-(3-fluoroanilino)cyclopentane-1-carbaldehyde
CID 89309233
4-[(5-fluoropyrimidin-2-yl)amino]oxolan-3-ol
CID 130991603
4-(4-bromo-2-fluoroanilino)oxolan-3-ol
CID 60898846

Frequently Asked Questions

What is the IUPAC name of 4-(3-fluoroanilino)oxolan-3-ol?
The IUPAC name of 4-(3-fluoroanilino)oxolan-3-ol (CID 60896820) is 4-(3-fluoroanilino)oxolan-3-ol.
What is the SMILES notation for 4-(3-fluoroanilino)oxolan-3-ol?
The canonical SMILES for 4-(3-fluoroanilino)oxolan-3-ol is OC1COCC1Nc1cccc(F)c1.
What is the InChIKey of 4-(3-fluoroanilino)oxolan-3-ol?
The InChIKey is IHVBLEKVRFRKKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12FNO2/c11-7-2-1-3-8(4-7)12-9-5-14-6-10(9)13/h1-4,9-10,12-13H,5-6H2.
What are the key properties of 4-(3-fluoroanilino)oxolan-3-ol?
4-(3-fluoroanilino)oxolan-3-ol has a molecular weight of 197.21 g/mol, XLogP of 1.00, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-fluoroanilino)oxolan-3-ol is sourced from PubChem (CID 60896820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).