(4R)-4-amino-1,1,1,3,3-pentafluoropentan-2-one

C5H6F5NO — CID 166720444

IUPAC(4R)-4-amino-1,1,1,3,3-pentafluoropentan-2-one
SMILESC[C@@H](N)C(F)(F)C(=O)C(F)(F)F
InChIInChI=1S/C5H6F5NO/c1-2(11)4(6,7)3(12)5(8,9)10/h2H,11H2,1H3/t2-/m1/s1
InChIKeyAAPHHKAYINFRCW-UWTATZPHSA-N
MW191.10 g/mol
LogP1.10
Rot. Bonds2

About (4R)-4-amino-1,1,1,3,3-pentafluoropentan-2-one

(4R)-4-amino-1,1,1,3,3-pentafluoropentan-2-one (PubChem CID 166720444) has the molecular formula C5H6F5NO and a molecular weight of 191.10 g/mol. Its IUPAC name is (4R)-4-amino-1,1,1,3,3-pentafluoropentan-2-one.

Molecular Properties

Compound Name(4R)-4-amino-1,1,1,3,3-pentafluoropentan-2-one
PubChem CID166720444
Molecular FormulaC5H6F5NO
Molecular Weight191.10 g/mol
Exact Mass191.04
IUPAC Name(4R)-4-amino-1,1,1,3,3-pentafluoropentan-2-one
SMILESC[C@@H](N)C(F)(F)C(=O)C(F)(F)F
InChIInChI=1S/C5H6F5NO/c1-2(11)4(6,7)3(12)5(8,9)10/h2H,11H2,1H3/t2-/m1/s1
InChIKeyAAPHHKAYINFRCW-UWTATZPHSA-N
XLogP1.10
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.10
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (4R)-4-amino-1,1,1,3,3-pentafluoropentan-2-one?
The IUPAC name of (4R)-4-amino-1,1,1,3,3-pentafluoropentan-2-one (CID 166720444) is (4R)-4-amino-1,1,1,3,3-pentafluoropentan-2-one.
What is the SMILES notation for (4R)-4-amino-1,1,1,3,3-pentafluoropentan-2-one?
The canonical SMILES for (4R)-4-amino-1,1,1,3,3-pentafluoropentan-2-one is C[C@@H](N)C(F)(F)C(=O)C(F)(F)F.
What is the InChIKey of (4R)-4-amino-1,1,1,3,3-pentafluoropentan-2-one?
The InChIKey is AAPHHKAYINFRCW-UWTATZPHSA-N. The full InChI is InChI=1S/C5H6F5NO/c1-2(11)4(6,7)3(12)5(8,9)10/h2H,11H2,1H3/t2-/m1/s1.
What are the key properties of (4R)-4-amino-1,1,1,3,3-pentafluoropentan-2-one?
(4R)-4-amino-1,1,1,3,3-pentafluoropentan-2-one has a molecular weight of 191.10 g/mol, XLogP of 1.10, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-4-amino-1,1,1,3,3-pentafluoropentan-2-one is sourced from PubChem (CID 166720444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).