(2R)-2-amino-N-[[5-(2-methylpropyl)-1,2-oxazol-3-yl]methyl]-2-phenylacetamide

C16H21N3O2 — CID 56864135

IUPAC(2R)-2-amino-N-[[5-(2-methylpropyl)-1,2-oxazol-3-yl]methyl]-2-phenylacetamide
SMILESCC(C)Cc1cc(CNC(=O)[C@H](N)c2ccccc2)no1
InChIInChI=1S/C16H21N3O2/c1-11(2)8-14-9-13(19-21-14)10-18-16(20)15(17)12-6-4-3-5-7-12/h3-7,9,11,15H,8,10,17H2,1-2H3,(H,18,20)/t15-/m1/s1
InChIKeyAUAJFFOZQGVFIF-OAHLLOKOSA-N
MW287.36 g/mol
LogP2.19
Rot. Bonds6

About (2R)-2-amino-N-[[5-(2-methylpropyl)-1,2-oxazol-3-yl]methyl]-2-phenylacetamide

(2R)-2-amino-N-[[5-(2-methylpropyl)-1,2-oxazol-3-yl]methyl]-2-phenylacetamide (PubChem CID 56864135) has the molecular formula C16H21N3O2 and a molecular weight of 287.36 g/mol. Its IUPAC name is (2R)-2-amino-N-[[5-(2-methylpropyl)-1,2-oxazol-3-yl]methyl]-2-phenylacetamide.

Molecular Properties

Compound Name(2R)-2-amino-N-[[5-(2-methylpropyl)-1,2-oxazol-3-yl]methyl]-2-phenylacetamide
PubChem CID56864135
Molecular FormulaC16H21N3O2
Molecular Weight287.36 g/mol
Exact Mass287.16
IUPAC Name(2R)-2-amino-N-[[5-(2-methylpropyl)-1,2-oxazol-3-yl]methyl]-2-phenylacetamide
SMILESCC(C)Cc1cc(CNC(=O)[C@H](N)c2ccccc2)no1
InChIInChI=1S/C16H21N3O2/c1-11(2)8-14-9-13(19-21-14)10-18-16(20)15(17)12-6-4-3-5-7-12/h3-7,9,11,15H,8,10,17H2,1-2H3,(H,18,20)/t15-/m1/s1
InChIKeyAUAJFFOZQGVFIF-OAHLLOKOSA-N
XLogP2.19
TPSA81.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.36
LogP ≤ 52.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-[[5-(2-methylpropyl)-1,2-oxazol-3-yl]methyl]-2-phenylacetamide?
The IUPAC name of (2R)-2-amino-N-[[5-(2-methylpropyl)-1,2-oxazol-3-yl]methyl]-2-phenylacetamide (CID 56864135) is (2R)-2-amino-N-[[5-(2-methylpropyl)-1,2-oxazol-3-yl]methyl]-2-phenylacetamide.
What is the SMILES notation for (2R)-2-amino-N-[[5-(2-methylpropyl)-1,2-oxazol-3-yl]methyl]-2-phenylacetamide?
The canonical SMILES for (2R)-2-amino-N-[[5-(2-methylpropyl)-1,2-oxazol-3-yl]methyl]-2-phenylacetamide is CC(C)Cc1cc(CNC(=O)[C@H](N)c2ccccc2)no1.
What is the InChIKey of (2R)-2-amino-N-[[5-(2-methylpropyl)-1,2-oxazol-3-yl]methyl]-2-phenylacetamide?
The InChIKey is AUAJFFOZQGVFIF-OAHLLOKOSA-N. The full InChI is InChI=1S/C16H21N3O2/c1-11(2)8-14-9-13(19-21-14)10-18-16(20)15(17)12-6-4-3-5-7-12/h3-7,9,11,15H,8,10,17H2,1-2H3,(H,18,20)/t15-/m1/s1.
What are the key properties of (2R)-2-amino-N-[[5-(2-methylpropyl)-1,2-oxazol-3-yl]methyl]-2-phenylacetamide?
(2R)-2-amino-N-[[5-(2-methylpropyl)-1,2-oxazol-3-yl]methyl]-2-phenylacetamide has a molecular weight of 287.36 g/mol, XLogP of 2.19, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-[[5-(2-methylpropyl)-1,2-oxazol-3-yl]methyl]-2-phenylacetamide is sourced from PubChem (CID 56864135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).