(2R,3R)-2,3-difluoro-2-methyl-3-phenylpropanamide

C10H11F2NO — CID 155931604

IUPAC(2R,3R)-2,3-difluoro-2-methyl-3-phenylpropanamide
SMILESC[C@@](F)(C(N)=O)[C@H](F)c1ccccc1
InChIInChI=1S/C10H11F2NO/c1-10(12,9(13)14)8(11)7-5-3-2-4-6-7/h2-6,8H,1H3,(H2,13,14)/t8-,10+/m1/s1
InChIKeyJTDMHJFUOIDDEW-SCZZXKLOSA-N
MW199.20 g/mol
LogP1.91
Rot. Bonds3

About (2R,3R)-2,3-difluoro-2-methyl-3-phenylpropanamide

(2R,3R)-2,3-difluoro-2-methyl-3-phenylpropanamide (PubChem CID 155931604) has the molecular formula C10H11F2NO and a molecular weight of 199.20 g/mol. Its IUPAC name is (2R,3R)-2,3-difluoro-2-methyl-3-phenylpropanamide.

Molecular Properties

Compound Name(2R,3R)-2,3-difluoro-2-methyl-3-phenylpropanamide
PubChem CID155931604
Molecular FormulaC10H11F2NO
Molecular Weight199.20 g/mol
Exact Mass199.08
IUPAC Name(2R,3R)-2,3-difluoro-2-methyl-3-phenylpropanamide
SMILESC[C@@](F)(C(N)=O)[C@H](F)c1ccccc1
InChIInChI=1S/C10H11F2NO/c1-10(12,9(13)14)8(11)7-5-3-2-4-6-7/h2-6,8H,1H3,(H2,13,14)/t8-,10+/m1/s1
InChIKeyJTDMHJFUOIDDEW-SCZZXKLOSA-N
XLogP1.91
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.20
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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2,2-bis(1-phenylethyl)propanediamide
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2-phenyl-2-(1,2,2,2-tetrafluoroethoxy)acetamide
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2-benzhydrylsulfanyl-2-methylpropanamide
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(3-oxo-2-phenylbutyl) trifluoromethanesulfonate
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(2S,3S)-3-amino-2-methyl-3-phenylpropanoic acid;2,2,2-trifluoroacetic acid
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Frequently Asked Questions

What is the IUPAC name of (2R,3R)-2,3-difluoro-2-methyl-3-phenylpropanamide?
The IUPAC name of (2R,3R)-2,3-difluoro-2-methyl-3-phenylpropanamide (CID 155931604) is (2R,3R)-2,3-difluoro-2-methyl-3-phenylpropanamide.
What is the SMILES notation for (2R,3R)-2,3-difluoro-2-methyl-3-phenylpropanamide?
The canonical SMILES for (2R,3R)-2,3-difluoro-2-methyl-3-phenylpropanamide is C[C@@](F)(C(N)=O)[C@H](F)c1ccccc1.
What is the InChIKey of (2R,3R)-2,3-difluoro-2-methyl-3-phenylpropanamide?
The InChIKey is JTDMHJFUOIDDEW-SCZZXKLOSA-N. The full InChI is InChI=1S/C10H11F2NO/c1-10(12,9(13)14)8(11)7-5-3-2-4-6-7/h2-6,8H,1H3,(H2,13,14)/t8-,10+/m1/s1.
What are the key properties of (2R,3R)-2,3-difluoro-2-methyl-3-phenylpropanamide?
(2R,3R)-2,3-difluoro-2-methyl-3-phenylpropanamide has a molecular weight of 199.20 g/mol, XLogP of 1.91, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3R)-2,3-difluoro-2-methyl-3-phenylpropanamide is sourced from PubChem (CID 155931604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).