N,2-dimethyl-N-(2,2,2-trifluoroethyl)propanamide

C7H12F3NO — CID 60758557

IUPACN,2-dimethyl-N-(2,2,2-trifluoroethyl)propanamide
SMILESCC(C)C(=O)N(C)CC(F)(F)F
InChIInChI=1S/C7H12F3NO/c1-5(2)6(12)11(3)4-7(8,9)10/h5H,4H2,1-3H3
InChIKeyNSYXNSTZVSMMSM-UHFFFAOYSA-N
MW183.17 g/mol
LogP1.66
Rot. Bonds2

About N,2-dimethyl-N-(2,2,2-trifluoroethyl)propanamide

N,2-dimethyl-N-(2,2,2-trifluoroethyl)propanamide (PubChem CID 60758557) has the molecular formula C7H12F3NO and a molecular weight of 183.17 g/mol. Its IUPAC name is N,2-dimethyl-N-(2,2,2-trifluoroethyl)propanamide.

Molecular Properties

Compound NameN,2-dimethyl-N-(2,2,2-trifluoroethyl)propanamide
PubChem CID60758557
Molecular FormulaC7H12F3NO
Molecular Weight183.17 g/mol
Exact Mass183.09
IUPAC NameN,2-dimethyl-N-(2,2,2-trifluoroethyl)propanamide
SMILESCC(C)C(=O)N(C)CC(F)(F)F
InChIInChI=1S/C7H12F3NO/c1-5(2)6(12)11(3)4-7(8,9)10/h5H,4H2,1-3H3
InChIKeyNSYXNSTZVSMMSM-UHFFFAOYSA-N
XLogP1.66
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.17
LogP ≤ 51.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-N-(2,2,2-trifluoroethyl)propanamide?
The IUPAC name of N,2-dimethyl-N-(2,2,2-trifluoroethyl)propanamide (CID 60758557) is N,2-dimethyl-N-(2,2,2-trifluoroethyl)propanamide.
What is the SMILES notation for N,2-dimethyl-N-(2,2,2-trifluoroethyl)propanamide?
The canonical SMILES for N,2-dimethyl-N-(2,2,2-trifluoroethyl)propanamide is CC(C)C(=O)N(C)CC(F)(F)F.
What is the InChIKey of N,2-dimethyl-N-(2,2,2-trifluoroethyl)propanamide?
The InChIKey is NSYXNSTZVSMMSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12F3NO/c1-5(2)6(12)11(3)4-7(8,9)10/h5H,4H2,1-3H3.
What are the key properties of N,2-dimethyl-N-(2,2,2-trifluoroethyl)propanamide?
N,2-dimethyl-N-(2,2,2-trifluoroethyl)propanamide has a molecular weight of 183.17 g/mol, XLogP of 1.66, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-N-(2,2,2-trifluoroethyl)propanamide is sourced from PubChem (CID 60758557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).