2-(difluoromethyl)-1,3-oxazol-5-amine

C4H4F2N2O — CID 84762382

IUPAC2-(difluoromethyl)-1,3-oxazol-5-amine
SMILESNc1cnc(C(F)F)o1
InChIInChI=1S/C4H4F2N2O/c5-3(6)4-8-1-2(7)9-4/h1,3H,7H2
InChIKeyASKKLYCKTULGFR-UHFFFAOYSA-N
MW134.09 g/mol
LogP1.19
Rot. Bonds1

About 2-(difluoromethyl)-1,3-oxazol-5-amine

2-(difluoromethyl)-1,3-oxazol-5-amine (PubChem CID 84762382) has the molecular formula C4H4F2N2O and a molecular weight of 134.09 g/mol. Its IUPAC name is 2-(difluoromethyl)-1,3-oxazol-5-amine.

Molecular Properties

Compound Name2-(difluoromethyl)-1,3-oxazol-5-amine
PubChem CID84762382
Molecular FormulaC4H4F2N2O
Molecular Weight134.09 g/mol
Exact Mass134.03
IUPAC Name2-(difluoromethyl)-1,3-oxazol-5-amine
SMILESNc1cnc(C(F)F)o1
InChIInChI=1S/C4H4F2N2O/c5-3(6)4-8-1-2(7)9-4/h1,3H,7H2
InChIKeyASKKLYCKTULGFR-UHFFFAOYSA-N
XLogP1.19
TPSA52.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.09
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(difluoromethyl)-1,3-oxazol-5-amine?
The IUPAC name of 2-(difluoromethyl)-1,3-oxazol-5-amine (CID 84762382) is 2-(difluoromethyl)-1,3-oxazol-5-amine.
What is the SMILES notation for 2-(difluoromethyl)-1,3-oxazol-5-amine?
The canonical SMILES for 2-(difluoromethyl)-1,3-oxazol-5-amine is Nc1cnc(C(F)F)o1.
What is the InChIKey of 2-(difluoromethyl)-1,3-oxazol-5-amine?
The InChIKey is ASKKLYCKTULGFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H4F2N2O/c5-3(6)4-8-1-2(7)9-4/h1,3H,7H2.
What are the key properties of 2-(difluoromethyl)-1,3-oxazol-5-amine?
2-(difluoromethyl)-1,3-oxazol-5-amine has a molecular weight of 134.09 g/mol, XLogP of 1.19, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(difluoromethyl)-1,3-oxazol-5-amine is sourced from PubChem (CID 84762382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).