(2S)-2-[2-(4-fluorophenyl)ethylamino]-2-phenylacetamide

C16H17FN2O — CID 33406037

IUPAC(2S)-2-[2-(4-fluorophenyl)ethylamino]-2-phenylacetamide
SMILESNC(=O)[C@@H](NCCc1ccc(F)cc1)c1ccccc1
InChIInChI=1S/C16H17FN2O/c17-14-8-6-12(7-9-14)10-11-19-15(16(18)20)13-4-2-1-3-5-13/h1-9,15,19H,10-11H2,(H2,18,20)/t15-/m0/s1
InChIKeyIPSSKKYMZUPTNY-HNNXBMFYSA-N
MW272.32 g/mol
LogP2.18
Rot. Bonds6

About (2S)-2-[2-(4-fluorophenyl)ethylamino]-2-phenylacetamide

(2S)-2-[2-(4-fluorophenyl)ethylamino]-2-phenylacetamide (PubChem CID 33406037) has the molecular formula C16H17FN2O and a molecular weight of 272.32 g/mol. Its IUPAC name is (2S)-2-[2-(4-fluorophenyl)ethylamino]-2-phenylacetamide.

Molecular Properties

Compound Name(2S)-2-[2-(4-fluorophenyl)ethylamino]-2-phenylacetamide
PubChem CID33406037
Molecular FormulaC16H17FN2O
Molecular Weight272.32 g/mol
Exact Mass272.13
IUPAC Name(2S)-2-[2-(4-fluorophenyl)ethylamino]-2-phenylacetamide
SMILESNC(=O)[C@@H](NCCc1ccc(F)cc1)c1ccccc1
InChIInChI=1S/C16H17FN2O/c17-14-8-6-12(7-9-14)10-11-19-15(16(18)20)13-4-2-1-3-5-13/h1-9,15,19H,10-11H2,(H2,18,20)/t15-/m0/s1
InChIKeyIPSSKKYMZUPTNY-HNNXBMFYSA-N
XLogP2.18
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.32
LogP ≤ 52.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-2-[2-[4-(3,5-dimethylpyrazol-1-yl)phenyl]ethylamino]-2-phenylacetamide
CID 94641301
2-[2-(cyclohexen-1-yl)ethylamino]-2-phenylacetamide
CID 42931151
2-(butylamino)-2-phenylacetamide
CID 14569005
(2S)-2-[2-[[2-(3-fluorophenyl)acetyl]amino]ethylamino]-2-phenylacetamide
CID 94812771
2-[2-(4-fluorophenyl)ethylamino]-N-(5-methyl-1,2-oxazol-3-yl)-2-phenylacetamide
CID 86913137
(2S)-2-[2-(4-fluorophenyl)ethylamino]-3-methylpentanamide
CID 141217094
2-(3-fluorophenyl)-2-(2-phenylethylamino)acetic acid
CID 84746879
(2R)-2-[(2-fluorophenyl)methylamino]-2-phenylacetamide
CID 33473493
(2S)-2-[2-(4-fluorophenyl)ethylcarbamoylamino]-N,2-diphenylacetamide
CID 51957933
N'-[2-(4-fluorophenyl)ethyl]-N-(2-phenylethyl)oxamide
CID 3117526
N-[2-(4-fluorophenyl)ethyl]-3-phenylbutanamide
CID 2914347
ethyl 2-[(4-fluorophenyl)methylamino]-2-phenylacetate
CID 103600877

Frequently Asked Questions

What is the IUPAC name of (2S)-2-[2-(4-fluorophenyl)ethylamino]-2-phenylacetamide?
The IUPAC name of (2S)-2-[2-(4-fluorophenyl)ethylamino]-2-phenylacetamide (CID 33406037) is (2S)-2-[2-(4-fluorophenyl)ethylamino]-2-phenylacetamide.
What is the SMILES notation for (2S)-2-[2-(4-fluorophenyl)ethylamino]-2-phenylacetamide?
The canonical SMILES for (2S)-2-[2-(4-fluorophenyl)ethylamino]-2-phenylacetamide is NC(=O)[C@@H](NCCc1ccc(F)cc1)c1ccccc1.
What is the InChIKey of (2S)-2-[2-(4-fluorophenyl)ethylamino]-2-phenylacetamide?
The InChIKey is IPSSKKYMZUPTNY-HNNXBMFYSA-N. The full InChI is InChI=1S/C16H17FN2O/c17-14-8-6-12(7-9-14)10-11-19-15(16(18)20)13-4-2-1-3-5-13/h1-9,15,19H,10-11H2,(H2,18,20)/t15-/m0/s1.
What are the key properties of (2S)-2-[2-(4-fluorophenyl)ethylamino]-2-phenylacetamide?
(2S)-2-[2-(4-fluorophenyl)ethylamino]-2-phenylacetamide has a molecular weight of 272.32 g/mol, XLogP of 2.18, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-[2-(4-fluorophenyl)ethylamino]-2-phenylacetamide is sourced from PubChem (CID 33406037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).