2,2,3,3-tetrafluoro-N-[2-(2-hydroxyethyl)pentyl]propanamide

C10H17F4NO2 — CID 103820625

IUPAC2,2,3,3-tetrafluoro-N-[2-(2-hydroxyethyl)pentyl]propanamide
SMILESCCCC(CCO)CNC(=O)C(F)(F)C(F)F
InChIInChI=1S/C10H17F4NO2/c1-2-3-7(4-5-16)6-15-9(17)10(13,14)8(11)12/h7-8,16H,2-6H2,1H3,(H,15,17)
InChIKeyRWVZQZXEZBOUMB-UHFFFAOYSA-N
MW259.24 g/mol
LogP1.80
Rot. Bonds8

About 2,2,3,3-tetrafluoro-N-[2-(2-hydroxyethyl)pentyl]propanamide

2,2,3,3-tetrafluoro-N-[2-(2-hydroxyethyl)pentyl]propanamide (PubChem CID 103820625) has the molecular formula C10H17F4NO2 and a molecular weight of 259.24 g/mol. Its IUPAC name is 2,2,3,3-tetrafluoro-N-[2-(2-hydroxyethyl)pentyl]propanamide.

Molecular Properties

Compound Name2,2,3,3-tetrafluoro-N-[2-(2-hydroxyethyl)pentyl]propanamide
PubChem CID103820625
Molecular FormulaC10H17F4NO2
Molecular Weight259.24 g/mol
Exact Mass259.12
IUPAC Name2,2,3,3-tetrafluoro-N-[2-(2-hydroxyethyl)pentyl]propanamide
SMILESCCCC(CCO)CNC(=O)C(F)(F)C(F)F
InChIInChI=1S/C10H17F4NO2/c1-2-3-7(4-5-16)6-15-9(17)10(13,14)8(11)12/h7-8,16H,2-6H2,1H3,(H,15,17)
InChIKeyRWVZQZXEZBOUMB-UHFFFAOYSA-N
XLogP1.80
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.24
LogP ≤ 51.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4,4,4-trifluoro-N-[(1R*)-1-(trans-3-hydroxycyclobutyl)propyl]butanamide
CID 91768221
2,2,2-trifluoro-N-(5-hydroxy-2-methylpentyl)acetamide
CID 87580737
2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-pentadecafluoro-N-[6-hydroxy-5-(hydroxymethyl)hexyl]octanamide
CID 87965865
2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-pentadecafluoro-N-[6-hydroxy-4-(2-hydroxyethyl)hexyl]octanamide
CID 87965965
N-[5,5,5-trifluoro-4-(hydroxymethyl)pentyl]acetamide
CID 88125185
N-(2,2-dimethylhexyl)acetamide;(2R)-2-methyl-2-(trifluoromethyl)hexan-1-ol
CID 145149400
ethane;N-(2-methylhexyl)acetamide;(2R)-2-methyl-2-(trifluoromethyl)hexan-1-ol
CID 145149403
3,3,3-trifluoro-N-[[(1R,2S)-2-(hydroxymethyl)-3-propylcyclobutyl]methyl]propanamide
CID 157466471
4,4,4-trifluoro-N-(4-hydroxypentyl)-3-methylbutanamide
CID 168158646
5,5,5-trifluoro-N-(4-hydroxypentyl)-3-methylpentanamide
CID 168158668
2,4,4-trifluoro-N-(4-hydroxypentyl)-3-methylbutanamide
CID 175403237
ethane;2,2,2-trifluoro-N-(6-hydroxyhexyl)acetamide
CID 176937290

Frequently Asked Questions

What is the IUPAC name of 2,2,3,3-tetrafluoro-N-[2-(2-hydroxyethyl)pentyl]propanamide?
The IUPAC name of 2,2,3,3-tetrafluoro-N-[2-(2-hydroxyethyl)pentyl]propanamide (CID 103820625) is 2,2,3,3-tetrafluoro-N-[2-(2-hydroxyethyl)pentyl]propanamide.
What is the SMILES notation for 2,2,3,3-tetrafluoro-N-[2-(2-hydroxyethyl)pentyl]propanamide?
The canonical SMILES for 2,2,3,3-tetrafluoro-N-[2-(2-hydroxyethyl)pentyl]propanamide is CCCC(CCO)CNC(=O)C(F)(F)C(F)F.
What is the InChIKey of 2,2,3,3-tetrafluoro-N-[2-(2-hydroxyethyl)pentyl]propanamide?
The InChIKey is RWVZQZXEZBOUMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17F4NO2/c1-2-3-7(4-5-16)6-15-9(17)10(13,14)8(11)12/h7-8,16H,2-6H2,1H3,(H,15,17).
What are the key properties of 2,2,3,3-tetrafluoro-N-[2-(2-hydroxyethyl)pentyl]propanamide?
2,2,3,3-tetrafluoro-N-[2-(2-hydroxyethyl)pentyl]propanamide has a molecular weight of 259.24 g/mol, XLogP of 1.80, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,3,3-tetrafluoro-N-[2-(2-hydroxyethyl)pentyl]propanamide is sourced from PubChem (CID 103820625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).