(2R)-2-[(1R)-3,3-difluorocyclopentyl]-2-(2-hydroxyphenyl)acetamide

C13H15F2NO2 — CID 90958430

IUPAC(2R)-2-[(1R)-3,3-difluorocyclopentyl]-2-(2-hydroxyphenyl)acetamide
SMILESNC(=O)[C@@H](c1ccccc1O)[C@@H]1CCC(F)(F)C1
InChIInChI=1S/C13H15F2NO2/c14-13(15)6-5-8(7-13)11(12(16)18)9-3-1-2-4-10(9)17/h1-4,8,11,17H,5-7H2,(H2,16,18)/t8-,11-/m1/s1
InChIKeyRKBRRZYCOQIZIO-LDYMZIIASA-N
MW255.26 g/mol
LogP2.40
Rot. Bonds3

About (2R)-2-[(1R)-3,3-difluorocyclopentyl]-2-(2-hydroxyphenyl)acetamide

(2R)-2-[(1R)-3,3-difluorocyclopentyl]-2-(2-hydroxyphenyl)acetamide (PubChem CID 90958430) has the molecular formula C13H15F2NO2 and a molecular weight of 255.26 g/mol. Its IUPAC name is (2R)-2-[(1R)-3,3-difluorocyclopentyl]-2-(2-hydroxyphenyl)acetamide.

Molecular Properties

Compound Name(2R)-2-[(1R)-3,3-difluorocyclopentyl]-2-(2-hydroxyphenyl)acetamide
PubChem CID90958430
Molecular FormulaC13H15F2NO2
Molecular Weight255.26 g/mol
Exact Mass255.11
IUPAC Name(2R)-2-[(1R)-3,3-difluorocyclopentyl]-2-(2-hydroxyphenyl)acetamide
SMILESNC(=O)[C@@H](c1ccccc1O)[C@@H]1CCC(F)(F)C1
InChIInChI=1S/C13H15F2NO2/c14-13(15)6-5-8(7-13)11(12(16)18)9-3-1-2-4-10(9)17/h1-4,8,11,17H,5-7H2,(H2,16,18)/t8-,11-/m1/s1
InChIKeyRKBRRZYCOQIZIO-LDYMZIIASA-N
XLogP2.40
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.26
LogP ≤ 52.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-[(1R)-3,3-difluorocyclopentyl]-2-(2-hydroxyphenyl)acetamide?
The IUPAC name of (2R)-2-[(1R)-3,3-difluorocyclopentyl]-2-(2-hydroxyphenyl)acetamide (CID 90958430) is (2R)-2-[(1R)-3,3-difluorocyclopentyl]-2-(2-hydroxyphenyl)acetamide.
What is the SMILES notation for (2R)-2-[(1R)-3,3-difluorocyclopentyl]-2-(2-hydroxyphenyl)acetamide?
The canonical SMILES for (2R)-2-[(1R)-3,3-difluorocyclopentyl]-2-(2-hydroxyphenyl)acetamide is NC(=O)[C@@H](c1ccccc1O)[C@@H]1CCC(F)(F)C1.
What is the InChIKey of (2R)-2-[(1R)-3,3-difluorocyclopentyl]-2-(2-hydroxyphenyl)acetamide?
The InChIKey is RKBRRZYCOQIZIO-LDYMZIIASA-N. The full InChI is InChI=1S/C13H15F2NO2/c14-13(15)6-5-8(7-13)11(12(16)18)9-3-1-2-4-10(9)17/h1-4,8,11,17H,5-7H2,(H2,16,18)/t8-,11-/m1/s1.
What are the key properties of (2R)-2-[(1R)-3,3-difluorocyclopentyl]-2-(2-hydroxyphenyl)acetamide?
(2R)-2-[(1R)-3,3-difluorocyclopentyl]-2-(2-hydroxyphenyl)acetamide has a molecular weight of 255.26 g/mol, XLogP of 2.40, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[(1R)-3,3-difluorocyclopentyl]-2-(2-hydroxyphenyl)acetamide is sourced from PubChem (CID 90958430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).