4-hydroxy-N-propyl-N-(2,2,2-trifluoroethyl)pentanamide

C10H18F3NO2 — CID 79204647

IUPAC4-hydroxy-N-propyl-N-(2,2,2-trifluoroethyl)pentanamide
SMILESCCCN(CC(F)(F)F)C(=O)CCC(C)O
InChIInChI=1S/C10H18F3NO2/c1-3-6-14(7-10(11,12)13)9(16)5-4-8(2)15/h8,15H,3-7H2,1-2H3
InChIKeyFUZRYKAKMIXGCO-UHFFFAOYSA-N
MW241.25 g/mol
LogP1.95
Rot. Bonds6

About 4-hydroxy-N-propyl-N-(2,2,2-trifluoroethyl)pentanamide

4-hydroxy-N-propyl-N-(2,2,2-trifluoroethyl)pentanamide (PubChem CID 79204647) has the molecular formula C10H18F3NO2 and a molecular weight of 241.25 g/mol. Its IUPAC name is 4-hydroxy-N-propyl-N-(2,2,2-trifluoroethyl)pentanamide.

Molecular Properties

Compound Name4-hydroxy-N-propyl-N-(2,2,2-trifluoroethyl)pentanamide
PubChem CID79204647
Molecular FormulaC10H18F3NO2
Molecular Weight241.25 g/mol
Exact Mass241.13
IUPAC Name4-hydroxy-N-propyl-N-(2,2,2-trifluoroethyl)pentanamide
SMILESCCCN(CC(F)(F)F)C(=O)CCC(C)O
InChIInChI=1S/C10H18F3NO2/c1-3-6-14(7-10(11,12)13)9(16)5-4-8(2)15/h8,15H,3-7H2,1-2H3
InChIKeyFUZRYKAKMIXGCO-UHFFFAOYSA-N
XLogP1.95
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.25
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-N-propyl-N-(2,2,2-trifluoroethyl)pentanamide?
The IUPAC name of 4-hydroxy-N-propyl-N-(2,2,2-trifluoroethyl)pentanamide (CID 79204647) is 4-hydroxy-N-propyl-N-(2,2,2-trifluoroethyl)pentanamide.
What is the SMILES notation for 4-hydroxy-N-propyl-N-(2,2,2-trifluoroethyl)pentanamide?
The canonical SMILES for 4-hydroxy-N-propyl-N-(2,2,2-trifluoroethyl)pentanamide is CCCN(CC(F)(F)F)C(=O)CCC(C)O.
What is the InChIKey of 4-hydroxy-N-propyl-N-(2,2,2-trifluoroethyl)pentanamide?
The InChIKey is FUZRYKAKMIXGCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18F3NO2/c1-3-6-14(7-10(11,12)13)9(16)5-4-8(2)15/h8,15H,3-7H2,1-2H3.
What are the key properties of 4-hydroxy-N-propyl-N-(2,2,2-trifluoroethyl)pentanamide?
4-hydroxy-N-propyl-N-(2,2,2-trifluoroethyl)pentanamide has a molecular weight of 241.25 g/mol, XLogP of 1.95, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-N-propyl-N-(2,2,2-trifluoroethyl)pentanamide is sourced from PubChem (CID 79204647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).