2-amino-N-[1-(3-fluorophenyl)ethyl]-2-phenylpropanamide

C17H19FN2O — CID 62488779

IUPAC2-amino-N-[1-(3-fluorophenyl)ethyl]-2-phenylpropanamide
SMILESCC(NC(=O)C(C)(N)c1ccccc1)c1cccc(F)c1
InChIInChI=1S/C17H19FN2O/c1-12(13-7-6-10-15(18)11-13)20-16(21)17(2,19)14-8-4-3-5-9-14/h3-12H,19H2,1-2H3,(H,20,21)
InChIKeyAUNUSGIQARTIBM-UHFFFAOYSA-N
MW286.35 g/mol
LogP2.88
Rot. Bonds4

About 2-amino-N-[1-(3-fluorophenyl)ethyl]-2-phenylpropanamide

2-amino-N-[1-(3-fluorophenyl)ethyl]-2-phenylpropanamide (PubChem CID 62488779) has the molecular formula C17H19FN2O and a molecular weight of 286.35 g/mol. Its IUPAC name is 2-amino-N-[1-(3-fluorophenyl)ethyl]-2-phenylpropanamide.

Molecular Properties

Compound Name2-amino-N-[1-(3-fluorophenyl)ethyl]-2-phenylpropanamide
PubChem CID62488779
Molecular FormulaC17H19FN2O
Molecular Weight286.35 g/mol
Exact Mass286.15
IUPAC Name2-amino-N-[1-(3-fluorophenyl)ethyl]-2-phenylpropanamide
SMILESCC(NC(=O)C(C)(N)c1ccccc1)c1cccc(F)c1
InChIInChI=1S/C17H19FN2O/c1-12(13-7-6-10-15(18)11-13)20-16(21)17(2,19)14-8-4-3-5-9-14/h3-12H,19H2,1-2H3,(H,20,21)
InChIKeyAUNUSGIQARTIBM-UHFFFAOYSA-N
XLogP2.88
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.35
LogP ≤ 52.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-2-phenyl-N-[1-[3-(trifluoromethyl)phenyl]ethyl]propanamide;hydrochloride
CID 120587065
2-amino-N-[1-[3-(difluoromethoxy)phenyl]ethyl]-2-phenylpropanamide
CID 120588639
2-amino-3,3,3-trifluoro-N-[1-(3-fluorophenyl)ethyl]-2-methylpropanamide
CID 79805972
2-amino-2-ethyl-N-[1-(3-fluorophenyl)ethyl]butanamide
CID 79814759
N-[(1S)-1-(3-fluorophenyl)ethyl]-2-methyl-2-(methylamino)propanamide
CID 81366459
2-amino-N-[1-(5-fluoro-2-methoxyphenyl)ethyl]-2-phenylpropanamide;hydrochloride
CID 120589076
4-amino-N-[(1S)-1-(3-fluorophenyl)ethyl]-4-methylpentanamide
CID 81366180
2-amino-N-[1-(3-fluorophenyl)ethyl]-3,3-dimethylbutanamide
CID 76897375
N-[(1R)-1-(3-fluorophenyl)ethyl]acetamide
CID 81366934
(2R)-2-amino-N-[(1R)-1-(3-fluorophenyl)ethyl]propanamide
CID 81364932
2-amino-N-[(1R)-1-(3-fluorophenyl)ethyl]propanamide
CID 81365596
(2S)-2-[(2-amino-2-phenylpropanoyl)amino]propanoic acid
CID 78991003

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[1-(3-fluorophenyl)ethyl]-2-phenylpropanamide?
The IUPAC name of 2-amino-N-[1-(3-fluorophenyl)ethyl]-2-phenylpropanamide (CID 62488779) is 2-amino-N-[1-(3-fluorophenyl)ethyl]-2-phenylpropanamide.
What is the SMILES notation for 2-amino-N-[1-(3-fluorophenyl)ethyl]-2-phenylpropanamide?
The canonical SMILES for 2-amino-N-[1-(3-fluorophenyl)ethyl]-2-phenylpropanamide is CC(NC(=O)C(C)(N)c1ccccc1)c1cccc(F)c1.
What is the InChIKey of 2-amino-N-[1-(3-fluorophenyl)ethyl]-2-phenylpropanamide?
The InChIKey is AUNUSGIQARTIBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19FN2O/c1-12(13-7-6-10-15(18)11-13)20-16(21)17(2,19)14-8-4-3-5-9-14/h3-12H,19H2,1-2H3,(H,20,21).
What are the key properties of 2-amino-N-[1-(3-fluorophenyl)ethyl]-2-phenylpropanamide?
2-amino-N-[1-(3-fluorophenyl)ethyl]-2-phenylpropanamide has a molecular weight of 286.35 g/mol, XLogP of 2.88, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[1-(3-fluorophenyl)ethyl]-2-phenylpropanamide is sourced from PubChem (CID 62488779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).