2-amino-N-(3,5-difluorophenyl)-3-phenylpropanamide

C15H14F2N2O — CID 24703610

IUPAC2-amino-N-(3,5-difluorophenyl)-3-phenylpropanamide
SMILESNC(Cc1ccccc1)C(=O)Nc1cc(F)cc(F)c1
InChIInChI=1S/C15H14F2N2O/c16-11-7-12(17)9-13(8-11)19-15(20)14(18)6-10-4-2-1-3-5-10/h1-5,7-9,14H,6,18H2,(H,19,20)
InChIKeyQKMQERLLWBEGJI-UHFFFAOYSA-N
MW276.29 g/mol
LogP2.47
Rot. Bonds4

About 2-amino-N-(3,5-difluorophenyl)-3-phenylpropanamide

2-amino-N-(3,5-difluorophenyl)-3-phenylpropanamide (PubChem CID 24703610) has the molecular formula C15H14F2N2O and a molecular weight of 276.29 g/mol. Its IUPAC name is 2-amino-N-(3,5-difluorophenyl)-3-phenylpropanamide.

Molecular Properties

Compound Name2-amino-N-(3,5-difluorophenyl)-3-phenylpropanamide
PubChem CID24703610
Molecular FormulaC15H14F2N2O
Molecular Weight276.29 g/mol
Exact Mass276.11
IUPAC Name2-amino-N-(3,5-difluorophenyl)-3-phenylpropanamide
SMILESNC(Cc1ccccc1)C(=O)Nc1cc(F)cc(F)c1
InChIInChI=1S/C15H14F2N2O/c16-11-7-12(17)9-13(8-11)19-15(20)14(18)6-10-4-2-1-3-5-10/h1-5,7-9,14H,6,18H2,(H,19,20)
InChIKeyQKMQERLLWBEGJI-UHFFFAOYSA-N
XLogP2.47
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.29
LogP ≤ 52.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-2-amino-N-(3-chloro-5-fluorophenyl)-3-phenylpropanamide
CID 107365994
(2S)-2-amino-N-(3-fluorophenyl)-3-phenylpropanamide
CID 22691298
2-amino-N-(3,5-difluorophenyl)-3-(4-hydroxyphenyl)propanamide
CID 76891970
2-amino-N-(3,5-dichloro-4-fluorophenyl)-3-phenylpropanamide
CID 107574453
(2R)-2-amino-N-(4-fluoro-3-methylphenyl)-3-phenylpropanamide
CID 78917568
(2S)-2-amino-N-(2-chloro-4,6-difluorophenyl)-3-phenylpropanamide
CID 83072762
(2S)-N-(3-acetamidophenyl)-2-amino-3-phenylpropanamide
CID 22691247
2-amino-N-(2,4-difluorophenyl)-3-phenylpropanamide
CID 24708745
3-amino-4-(3,5-difluoroanilino)-4-oxobutanoic acid
CID 64896445
2-amino-N-naphthalen-2-yl-3-phenylpropanamide
CID 577793
2-amino-N-(2-amino-5-fluorophenyl)-3-phenylpropanamide
CID 110483797
(2S)-2-amino-N-(6-fluoro-3-pyridinyl)-3-phenylpropanamide
CID 103794914

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(3,5-difluorophenyl)-3-phenylpropanamide?
The IUPAC name of 2-amino-N-(3,5-difluorophenyl)-3-phenylpropanamide (CID 24703610) is 2-amino-N-(3,5-difluorophenyl)-3-phenylpropanamide.
What is the SMILES notation for 2-amino-N-(3,5-difluorophenyl)-3-phenylpropanamide?
The canonical SMILES for 2-amino-N-(3,5-difluorophenyl)-3-phenylpropanamide is NC(Cc1ccccc1)C(=O)Nc1cc(F)cc(F)c1.
What is the InChIKey of 2-amino-N-(3,5-difluorophenyl)-3-phenylpropanamide?
The InChIKey is QKMQERLLWBEGJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14F2N2O/c16-11-7-12(17)9-13(8-11)19-15(20)14(18)6-10-4-2-1-3-5-10/h1-5,7-9,14H,6,18H2,(H,19,20).
What are the key properties of 2-amino-N-(3,5-difluorophenyl)-3-phenylpropanamide?
2-amino-N-(3,5-difluorophenyl)-3-phenylpropanamide has a molecular weight of 276.29 g/mol, XLogP of 2.47, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(3,5-difluorophenyl)-3-phenylpropanamide is sourced from PubChem (CID 24703610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).