4-(2-fluoroethylamino)oxolan-3-ol

C6H12FNO2 — CID 130503994

IUPAC4-(2-fluoroethylamino)oxolan-3-ol
SMILESOC1COCC1NCCF
InChIInChI=1S/C6H12FNO2/c7-1-2-8-5-3-10-4-6(5)9/h5-6,8-9H,1-4H2
InChIKeyXMOFAEGZZDRBMF-UHFFFAOYSA-N
MW149.16 g/mol
LogP-0.69
Rot. Bonds3

About 4-(2-fluoroethylamino)oxolan-3-ol

4-(2-fluoroethylamino)oxolan-3-ol (PubChem CID 130503994) has the molecular formula C6H12FNO2 and a molecular weight of 149.16 g/mol. Its IUPAC name is 4-(2-fluoroethylamino)oxolan-3-ol.

Molecular Properties

Compound Name4-(2-fluoroethylamino)oxolan-3-ol
PubChem CID130503994
Molecular FormulaC6H12FNO2
Molecular Weight149.16 g/mol
Exact Mass149.09
IUPAC Name4-(2-fluoroethylamino)oxolan-3-ol
SMILESOC1COCC1NCCF
InChIInChI=1S/C6H12FNO2/c7-1-2-8-5-3-10-4-6(5)9/h5-6,8-9H,1-4H2
InChIKeyXMOFAEGZZDRBMF-UHFFFAOYSA-N
XLogP-0.69
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms10
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.16
LogP ≤ 5-0.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(2-fluoroethylamino)oxolan-3-ol?
The IUPAC name of 4-(2-fluoroethylamino)oxolan-3-ol (CID 130503994) is 4-(2-fluoroethylamino)oxolan-3-ol.
What is the SMILES notation for 4-(2-fluoroethylamino)oxolan-3-ol?
The canonical SMILES for 4-(2-fluoroethylamino)oxolan-3-ol is OC1COCC1NCCF.
What is the InChIKey of 4-(2-fluoroethylamino)oxolan-3-ol?
The InChIKey is XMOFAEGZZDRBMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12FNO2/c7-1-2-8-5-3-10-4-6(5)9/h5-6,8-9H,1-4H2.
What are the key properties of 4-(2-fluoroethylamino)oxolan-3-ol?
4-(2-fluoroethylamino)oxolan-3-ol has a molecular weight of 149.16 g/mol, XLogP of -0.69, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-fluoroethylamino)oxolan-3-ol is sourced from PubChem (CID 130503994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).