N-[3-hydroxy-3-(trifluoromethyl)cyclobutyl]acetamide

C7H10F3NO2 — CID 131067302

IUPACN-[3-hydroxy-3-(trifluoromethyl)cyclobutyl]acetamide
SMILESCC(=O)NC1CC(O)(C(F)(F)F)C1
InChIInChI=1S/C7H10F3NO2/c1-4(12)11-5-2-6(13,3-5)7(8,9)10/h5,13H,2-3H2,1H3,(H,11,12)
InChIKeyIQKMPOGULUBIQX-UHFFFAOYSA-N
MW197.16 g/mol
LogP0.58
Rot. Bonds1

About N-[3-hydroxy-3-(trifluoromethyl)cyclobutyl]acetamide

N-[3-hydroxy-3-(trifluoromethyl)cyclobutyl]acetamide (PubChem CID 131067302) has the molecular formula C7H10F3NO2 and a molecular weight of 197.16 g/mol. Its IUPAC name is N-[3-hydroxy-3-(trifluoromethyl)cyclobutyl]acetamide.

Molecular Properties

Compound NameN-[3-hydroxy-3-(trifluoromethyl)cyclobutyl]acetamide
PubChem CID131067302
Molecular FormulaC7H10F3NO2
Molecular Weight197.16 g/mol
Exact Mass197.07
IUPAC NameN-[3-hydroxy-3-(trifluoromethyl)cyclobutyl]acetamide
SMILESCC(=O)NC1CC(O)(C(F)(F)F)C1
InChIInChI=1S/C7H10F3NO2/c1-4(12)11-5-2-6(13,3-5)7(8,9)10/h5,13H,2-3H2,1H3,(H,11,12)
InChIKeyIQKMPOGULUBIQX-UHFFFAOYSA-N
XLogP0.58
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.16
LogP ≤ 50.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[3-hydroxy-3-(trifluoromethyl)cyclobutyl]acetamide?
The IUPAC name of N-[3-hydroxy-3-(trifluoromethyl)cyclobutyl]acetamide (CID 131067302) is N-[3-hydroxy-3-(trifluoromethyl)cyclobutyl]acetamide.
What is the SMILES notation for N-[3-hydroxy-3-(trifluoromethyl)cyclobutyl]acetamide?
The canonical SMILES for N-[3-hydroxy-3-(trifluoromethyl)cyclobutyl]acetamide is CC(=O)NC1CC(O)(C(F)(F)F)C1.
What is the InChIKey of N-[3-hydroxy-3-(trifluoromethyl)cyclobutyl]acetamide?
The InChIKey is IQKMPOGULUBIQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10F3NO2/c1-4(12)11-5-2-6(13,3-5)7(8,9)10/h5,13H,2-3H2,1H3,(H,11,12).
What are the key properties of N-[3-hydroxy-3-(trifluoromethyl)cyclobutyl]acetamide?
N-[3-hydroxy-3-(trifluoromethyl)cyclobutyl]acetamide has a molecular weight of 197.16 g/mol, XLogP of 0.58, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-hydroxy-3-(trifluoromethyl)cyclobutyl]acetamide is sourced from PubChem (CID 131067302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).