N,N-diethyl-3,3,3-trifluoro-2-hydroxy-2-methylpropanamide

C8H14F3NO2 — CID 10703787

IUPACN,N-diethyl-3,3,3-trifluoro-2-hydroxy-2-methylpropanamide
SMILESCCN(CC)C(=O)C(C)(O)C(F)(F)F
InChIInChI=1S/C8H14F3NO2/c1-4-12(5-2)6(13)7(3,14)8(9,10)11/h14H,4-5H2,1-3H3
InChIKeyFJWFBICCXFBZRB-UHFFFAOYSA-N
MW213.20 g/mol
LogP1.17
Rot. Bonds3

About N,N-diethyl-3,3,3-trifluoro-2-hydroxy-2-methylpropanamide

N,N-diethyl-3,3,3-trifluoro-2-hydroxy-2-methylpropanamide (PubChem CID 10703787) has the molecular formula C8H14F3NO2 and a molecular weight of 213.20 g/mol. Its IUPAC name is N,N-diethyl-3,3,3-trifluoro-2-hydroxy-2-methylpropanamide.

Molecular Properties

Compound NameN,N-diethyl-3,3,3-trifluoro-2-hydroxy-2-methylpropanamide
PubChem CID10703787
Molecular FormulaC8H14F3NO2
Molecular Weight213.20 g/mol
Exact Mass213.10
IUPAC NameN,N-diethyl-3,3,3-trifluoro-2-hydroxy-2-methylpropanamide
SMILESCCN(CC)C(=O)C(C)(O)C(F)(F)F
InChIInChI=1S/C8H14F3NO2/c1-4-12(5-2)6(13)7(3,14)8(9,10)11/h14H,4-5H2,1-3H3
InChIKeyFJWFBICCXFBZRB-UHFFFAOYSA-N
XLogP1.17
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.20
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-3,3,3-trifluoro-2-hydroxy-2-methylpropanamide?
The IUPAC name of N,N-diethyl-3,3,3-trifluoro-2-hydroxy-2-methylpropanamide (CID 10703787) is N,N-diethyl-3,3,3-trifluoro-2-hydroxy-2-methylpropanamide.
What is the SMILES notation for N,N-diethyl-3,3,3-trifluoro-2-hydroxy-2-methylpropanamide?
The canonical SMILES for N,N-diethyl-3,3,3-trifluoro-2-hydroxy-2-methylpropanamide is CCN(CC)C(=O)C(C)(O)C(F)(F)F.
What is the InChIKey of N,N-diethyl-3,3,3-trifluoro-2-hydroxy-2-methylpropanamide?
The InChIKey is FJWFBICCXFBZRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14F3NO2/c1-4-12(5-2)6(13)7(3,14)8(9,10)11/h14H,4-5H2,1-3H3.
What are the key properties of N,N-diethyl-3,3,3-trifluoro-2-hydroxy-2-methylpropanamide?
N,N-diethyl-3,3,3-trifluoro-2-hydroxy-2-methylpropanamide has a molecular weight of 213.20 g/mol, XLogP of 1.17, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-3,3,3-trifluoro-2-hydroxy-2-methylpropanamide is sourced from PubChem (CID 10703787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).