2,2,2-trifluoro-N-[(3-hydroxycyclopentyl)methyl]acetamide

C8H12F3NO2 — CID 103280270

IUPAC2,2,2-trifluoro-N-[(3-hydroxycyclopentyl)methyl]acetamide
SMILESO=C(NCC1CCC(O)C1)C(F)(F)F
InChIInChI=1S/C8H12F3NO2/c9-8(10,11)7(14)12-4-5-1-2-6(13)3-5/h5-6,13H,1-4H2,(H,12,14)
InChIKeyODDHZBZZTGFOFJ-UHFFFAOYSA-N
MW211.18 g/mol
LogP0.83
Rot. Bonds2

About 2,2,2-trifluoro-N-[(3-hydroxycyclopentyl)methyl]acetamide

2,2,2-trifluoro-N-[(3-hydroxycyclopentyl)methyl]acetamide (PubChem CID 103280270) has the molecular formula C8H12F3NO2 and a molecular weight of 211.18 g/mol. Its IUPAC name is 2,2,2-trifluoro-N-[(3-hydroxycyclopentyl)methyl]acetamide.

Molecular Properties

Compound Name2,2,2-trifluoro-N-[(3-hydroxycyclopentyl)methyl]acetamide
PubChem CID103280270
Molecular FormulaC8H12F3NO2
Molecular Weight211.18 g/mol
Exact Mass211.08
IUPAC Name2,2,2-trifluoro-N-[(3-hydroxycyclopentyl)methyl]acetamide
SMILESO=C(NCC1CCC(O)C1)C(F)(F)F
InChIInChI=1S/C8H12F3NO2/c9-8(10,11)7(14)12-4-5-1-2-6(13)3-5/h5-6,13H,1-4H2,(H,12,14)
InChIKeyODDHZBZZTGFOFJ-UHFFFAOYSA-N
XLogP0.83
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.18
LogP ≤ 50.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,2,2-trifluoro-N-[(3-hydroxycyclopentyl)methyl]acetamide?
The IUPAC name of 2,2,2-trifluoro-N-[(3-hydroxycyclopentyl)methyl]acetamide (CID 103280270) is 2,2,2-trifluoro-N-[(3-hydroxycyclopentyl)methyl]acetamide.
What is the SMILES notation for 2,2,2-trifluoro-N-[(3-hydroxycyclopentyl)methyl]acetamide?
The canonical SMILES for 2,2,2-trifluoro-N-[(3-hydroxycyclopentyl)methyl]acetamide is O=C(NCC1CCC(O)C1)C(F)(F)F.
What is the InChIKey of 2,2,2-trifluoro-N-[(3-hydroxycyclopentyl)methyl]acetamide?
The InChIKey is ODDHZBZZTGFOFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12F3NO2/c9-8(10,11)7(14)12-4-5-1-2-6(13)3-5/h5-6,13H,1-4H2,(H,12,14).
What are the key properties of 2,2,2-trifluoro-N-[(3-hydroxycyclopentyl)methyl]acetamide?
2,2,2-trifluoro-N-[(3-hydroxycyclopentyl)methyl]acetamide has a molecular weight of 211.18 g/mol, XLogP of 0.83, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,2-trifluoro-N-[(3-hydroxycyclopentyl)methyl]acetamide is sourced from PubChem (CID 103280270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).