ethane-1,2-diol;2-fluoropropanamide

C5H12FNO3 — CID 175562566

IUPACethane-1,2-diol;2-fluoropropanamide
SMILESCC(F)C(N)=O.OCCO
InChIInChI=1S/C3H6FNO.C2H6O2/c1-2(4)3(5)6;3-1-2-4/h2H,1H3,(H2,5,6);3-4H,1-2H2
InChIKeyHMJAYWZKJBHTAL-UHFFFAOYSA-N
MW153.15 g/mol
LogP-1.20
Rot. Bonds2

About ethane-1,2-diol;2-fluoropropanamide

ethane-1,2-diol;2-fluoropropanamide (PubChem CID 175562566) has the molecular formula C5H12FNO3 and a molecular weight of 153.15 g/mol. Its IUPAC name is ethane-1,2-diol;2-fluoropropanamide.

Molecular Properties

Compound Nameethane-1,2-diol;2-fluoropropanamide
PubChem CID175562566
Molecular FormulaC5H12FNO3
Molecular Weight153.15 g/mol
Exact Mass153.08
IUPAC Nameethane-1,2-diol;2-fluoropropanamide
SMILESCC(F)C(N)=O.OCCO
InChIInChI=1S/C3H6FNO.C2H6O2/c1-2(4)3(5)6;3-1-2-4/h2H,1H3,(H2,5,6);3-4H,1-2H2
InChIKeyHMJAYWZKJBHTAL-UHFFFAOYSA-N
XLogP-1.20
TPSA83.55 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.15
LogP ≤ 5-1.20
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze ethane-1,2-diol;2-fluoropropanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of ethane-1,2-diol;2-fluoropropanamide?
The IUPAC name of ethane-1,2-diol;2-fluoropropanamide (CID 175562566) is ethane-1,2-diol;2-fluoropropanamide.
What is the SMILES notation for ethane-1,2-diol;2-fluoropropanamide?
The canonical SMILES for ethane-1,2-diol;2-fluoropropanamide is CC(F)C(N)=O.OCCO.
What is the InChIKey of ethane-1,2-diol;2-fluoropropanamide?
The InChIKey is HMJAYWZKJBHTAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H6FNO.C2H6O2/c1-2(4)3(5)6;3-1-2-4/h2H,1H3,(H2,5,6);3-4H,1-2H2.
What are the key properties of ethane-1,2-diol;2-fluoropropanamide?
ethane-1,2-diol;2-fluoropropanamide has a molecular weight of 153.15 g/mol, XLogP of -1.20, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane-1,2-diol;2-fluoropropanamide is sourced from PubChem (CID 175562566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).