N-[(1R)-2-amino-2-oxo-1-phenylethyl]-N-[(3-fluorophenyl)methyl]benzamide

C22H19FN2O2 — CID 118246886

IUPACN-[(1R)-2-amino-2-oxo-1-phenylethyl]-N-[(3-fluorophenyl)methyl]benzamide
SMILESNC(=O)[C@@H](c1ccccc1)N(Cc1cccc(F)c1)C(=O)c1ccccc1
InChIInChI=1S/C22H19FN2O2/c23-19-13-7-8-16(14-19)15-25(22(27)18-11-5-2-6-12-18)20(21(24)26)17-9-3-1-4-10-17/h1-14,20H,15H2,(H2,24,26)/t20-/m1/s1
InChIKeyLMCMLPSDKRXRRR-HXUWFJFHSA-N
MW362.40 g/mol
LogP3.69
Rot. Bonds6

About N-[(1R)-2-amino-2-oxo-1-phenylethyl]-N-[(3-fluorophenyl)methyl]benzamide

N-[(1R)-2-amino-2-oxo-1-phenylethyl]-N-[(3-fluorophenyl)methyl]benzamide (PubChem CID 118246886) has the molecular formula C22H19FN2O2 and a molecular weight of 362.40 g/mol. Its IUPAC name is N-[(1R)-2-amino-2-oxo-1-phenylethyl]-N-[(3-fluorophenyl)methyl]benzamide.

Molecular Properties

Compound NameN-[(1R)-2-amino-2-oxo-1-phenylethyl]-N-[(3-fluorophenyl)methyl]benzamide
PubChem CID118246886
Molecular FormulaC22H19FN2O2
Molecular Weight362.40 g/mol
Exact Mass362.14
IUPAC NameN-[(1R)-2-amino-2-oxo-1-phenylethyl]-N-[(3-fluorophenyl)methyl]benzamide
SMILESNC(=O)[C@@H](c1ccccc1)N(Cc1cccc(F)c1)C(=O)c1ccccc1
InChIInChI=1S/C22H19FN2O2/c23-19-13-7-8-16(14-19)15-25(22(27)18-11-5-2-6-12-18)20(21(24)26)17-9-3-1-4-10-17/h1-14,20H,15H2,(H2,24,26)/t20-/m1/s1
InChIKeyLMCMLPSDKRXRRR-HXUWFJFHSA-N
XLogP3.69
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.40
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(1R)-2-amino-2-oxo-1-phenylethyl]-N-[(3-methylphenyl)methyl]benzamide
CID 118246688
N-[(1R)-2-amino-2-oxo-1-phenylethyl]-N-[(3-cyclopropylphenyl)methyl]benzamide
CID 118246775
N-[(1R)-2-amino-2-oxo-1-phenylethyl]-N-[[4-(dimethylamino)phenyl]methyl]benzamide
CID 118246756
N-(2-amino-2-oxo-1-phenylethyl)-3-hydroxy-N-[(3-methoxyphenyl)methyl]benzamide
CID 118246798
N-[(3-fluorophenyl)methyl]-N-methylbenzamide
CID 60631048
[3-[[(1R)-2-amino-2-oxo-1-phenylethyl]-[(3-methoxyphenyl)methyl]carbamoyl]phenyl] acetate
CID 118246895
N-[(1R)-2-amino-2-oxo-1-phenylethyl]-N-[[2-(trifluoromethyl)phenyl]methyl]benzamide
CID 118246686
N-[(1R)-2-amino-2-oxo-1-phenylethyl]-2-hydroxy-N-[[3-(trifluoromethyl)phenyl]methyl]benzamide
CID 118246912
2-[(3-fluorophenyl)methyl-methylamino]-N,N-dimethyl-2-phenylacetamide
CID 78815730
N-[(3-aminophenyl)methyl]-3-fluoro-N-propan-2-ylbenzamide
CID 43460200
(2S)-2-[2-[[2-(3-fluorophenyl)acetyl]amino]ethylamino]-2-phenylacetamide
CID 94812771
N-[2-amino-1-(3-fluorophenyl)-2-oxoethyl]-3-(benzenesulfonylmethyl)-N-methylbenzamide
CID 56566627

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-2-amino-2-oxo-1-phenylethyl]-N-[(3-fluorophenyl)methyl]benzamide?
The IUPAC name of N-[(1R)-2-amino-2-oxo-1-phenylethyl]-N-[(3-fluorophenyl)methyl]benzamide (CID 118246886) is N-[(1R)-2-amino-2-oxo-1-phenylethyl]-N-[(3-fluorophenyl)methyl]benzamide.
What is the SMILES notation for N-[(1R)-2-amino-2-oxo-1-phenylethyl]-N-[(3-fluorophenyl)methyl]benzamide?
The canonical SMILES for N-[(1R)-2-amino-2-oxo-1-phenylethyl]-N-[(3-fluorophenyl)methyl]benzamide is NC(=O)[C@@H](c1ccccc1)N(Cc1cccc(F)c1)C(=O)c1ccccc1.
What is the InChIKey of N-[(1R)-2-amino-2-oxo-1-phenylethyl]-N-[(3-fluorophenyl)methyl]benzamide?
The InChIKey is LMCMLPSDKRXRRR-HXUWFJFHSA-N. The full InChI is InChI=1S/C22H19FN2O2/c23-19-13-7-8-16(14-19)15-25(22(27)18-11-5-2-6-12-18)20(21(24)26)17-9-3-1-4-10-17/h1-14,20H,15H2,(H2,24,26)/t20-/m1/s1.
What are the key properties of N-[(1R)-2-amino-2-oxo-1-phenylethyl]-N-[(3-fluorophenyl)methyl]benzamide?
N-[(1R)-2-amino-2-oxo-1-phenylethyl]-N-[(3-fluorophenyl)methyl]benzamide has a molecular weight of 362.40 g/mol, XLogP of 3.69, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-2-amino-2-oxo-1-phenylethyl]-N-[(3-fluorophenyl)methyl]benzamide is sourced from PubChem (CID 118246886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).