2,2,3,3-tetrafluoro-N-[(5-methyl-1,3-oxazol-2-yl)methyl]propanamide

C8H8F4N2O2 — CID 103737118

IUPAC2,2,3,3-tetrafluoro-N-[(5-methyl-1,3-oxazol-2-yl)methyl]propanamide
SMILESCc1cnc(CNC(=O)C(F)(F)C(F)F)o1
InChIInChI=1S/C8H8F4N2O2/c1-4-2-13-5(16-4)3-14-7(15)8(11,12)6(9)10/h2,6H,3H2,1H3,(H,14,15)
InChIKeySKFQWGXPNAXKFW-UHFFFAOYSA-N
MW240.16 g/mol
LogP1.50
Rot. Bonds4

About 2,2,3,3-tetrafluoro-N-[(5-methyl-1,3-oxazol-2-yl)methyl]propanamide

2,2,3,3-tetrafluoro-N-[(5-methyl-1,3-oxazol-2-yl)methyl]propanamide (PubChem CID 103737118) has the molecular formula C8H8F4N2O2 and a molecular weight of 240.16 g/mol. Its IUPAC name is 2,2,3,3-tetrafluoro-N-[(5-methyl-1,3-oxazol-2-yl)methyl]propanamide.

Molecular Properties

Compound Name2,2,3,3-tetrafluoro-N-[(5-methyl-1,3-oxazol-2-yl)methyl]propanamide
PubChem CID103737118
Molecular FormulaC8H8F4N2O2
Molecular Weight240.16 g/mol
Exact Mass240.05
IUPAC Name2,2,3,3-tetrafluoro-N-[(5-methyl-1,3-oxazol-2-yl)methyl]propanamide
SMILESCc1cnc(CNC(=O)C(F)(F)C(F)F)o1
InChIInChI=1S/C8H8F4N2O2/c1-4-2-13-5(16-4)3-14-7(15)8(11,12)6(9)10/h2,6H,3H2,1H3,(H,14,15)
InChIKeySKFQWGXPNAXKFW-UHFFFAOYSA-N
XLogP1.50
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.16
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}

Analyze 2,2,3,3-tetrafluoro-N-[(5-methyl-1,3-oxazol-2-yl)methyl]propanamide with MolForge

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Related Compounds

N-[(5-methyl-1,3-oxazol-2-yl)methyl]-2-sulfanylpropanamide
CID 106377758
1-ethyl-3-[(5-methyl-1,3-oxazol-2-yl)methyl]urea
CID 103738715
2-amino-N-[(5-methyl-1,3-oxazol-2-yl)methyl]acetamide
CID 83622965
2-(methylamino)-N-[(5-methyl-1,3-oxazol-2-yl)methyl]propanamide
CID 106371516
4-amino-4-methyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]pentanamide
CID 103811604
(2S)-2-amino-3-methyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]butanamide
CID 103797057
2-amino-N-[(5-methyl-1,3-oxazol-2-yl)methyl]butanamide
CID 103797047
2-(tert-butylamino)-N-[(5-methyl-1,3-oxazol-2-yl)methyl]acetamide
CID 103726080
3-(methylamino)-N-[(5-methyl-1,3-oxazol-2-yl)methyl]propanamide
CID 106371442
2-[(5-methyl-1,3-oxazol-2-yl)methylcarbamoylamino]acetic acid
CID 106374600
2,2,3,3-tetrafluoro-N-[(4-methylphenyl)methyl]propanamide
CID 103731962
2-[(Z)-N'-hydroxycarbamimidoyl]-N-[(5-methyl-1,3-oxazol-2-yl)methyl]-2-propylpentanamide
CID 106375729

Frequently Asked Questions

What is the IUPAC name of 2,2,3,3-tetrafluoro-N-[(5-methyl-1,3-oxazol-2-yl)methyl]propanamide?
The IUPAC name of 2,2,3,3-tetrafluoro-N-[(5-methyl-1,3-oxazol-2-yl)methyl]propanamide (CID 103737118) is 2,2,3,3-tetrafluoro-N-[(5-methyl-1,3-oxazol-2-yl)methyl]propanamide.
What is the SMILES notation for 2,2,3,3-tetrafluoro-N-[(5-methyl-1,3-oxazol-2-yl)methyl]propanamide?
The canonical SMILES for 2,2,3,3-tetrafluoro-N-[(5-methyl-1,3-oxazol-2-yl)methyl]propanamide is Cc1cnc(CNC(=O)C(F)(F)C(F)F)o1.
What is the InChIKey of 2,2,3,3-tetrafluoro-N-[(5-methyl-1,3-oxazol-2-yl)methyl]propanamide?
The InChIKey is SKFQWGXPNAXKFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8F4N2O2/c1-4-2-13-5(16-4)3-14-7(15)8(11,12)6(9)10/h2,6H,3H2,1H3,(H,14,15).
What are the key properties of 2,2,3,3-tetrafluoro-N-[(5-methyl-1,3-oxazol-2-yl)methyl]propanamide?
2,2,3,3-tetrafluoro-N-[(5-methyl-1,3-oxazol-2-yl)methyl]propanamide has a molecular weight of 240.16 g/mol, XLogP of 1.50, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,3,3-tetrafluoro-N-[(5-methyl-1,3-oxazol-2-yl)methyl]propanamide is sourced from PubChem (CID 103737118), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).