N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]-2-[(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)methoxy]acetamide

C19H20N4O4 — CID 97457797

IUPACN-[(2S)-1-hydroxy-3-phenylpropan-2-yl]-2-[(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)methoxy]acetamide
SMILESO=C(COCc1nc(-c2cccnc2)no1)N[C@H](CO)Cc1ccccc1
InChIInChI=1S/C19H20N4O4/c24-11-16(9-14-5-2-1-3-6-14)21-17(25)12-26-13-18-22-19(23-27-18)15-7-4-8-20-10-15/h1-8,10,16,24H,9,11-13H2,(H,21,25)/t16-/m0/s1
InChIKeyDOGWUYMPEUVZHT-INIZCTEOSA-N
MW368.39 g/mol
LogP1.37
Rot. Bonds9

About N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]-2-[(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)methoxy]acetamide

N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]-2-[(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)methoxy]acetamide (PubChem CID 97457797) has the molecular formula C19H20N4O4 and a molecular weight of 368.39 g/mol. Its IUPAC name is N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]-2-[(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)methoxy]acetamide.

Molecular Properties

Compound NameN-[(2S)-1-hydroxy-3-phenylpropan-2-yl]-2-[(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)methoxy]acetamide
PubChem CID97457797
Molecular FormulaC19H20N4O4
Molecular Weight368.39 g/mol
Exact Mass368.15
IUPAC NameN-[(2S)-1-hydroxy-3-phenylpropan-2-yl]-2-[(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)methoxy]acetamide
SMILESO=C(COCc1nc(-c2cccnc2)no1)N[C@H](CO)Cc1ccccc1
InChIInChI=1S/C19H20N4O4/c24-11-16(9-14-5-2-1-3-6-14)21-17(25)12-26-13-18-22-19(23-27-18)15-7-4-8-20-10-15/h1-8,10,16,24H,9,11-13H2,(H,21,25)/t16-/m0/s1
InChIKeyDOGWUYMPEUVZHT-INIZCTEOSA-N
XLogP1.37
TPSA110.37 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds9
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.39
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]-2-pyridin-3-ylacetamide
CID 102673691
1-piperidin-1-yl-2-[(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)methoxy]ethanone
CID 75538435
3-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)propyl (2S)-2-(furan-2-carbonylamino)-3-phenylpropanoate
CID 55939237
3-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)propanoic acid
CID 3159643
N-[1-[3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]-2-phenylethyl]-2-phenylmethoxyacetamide
CID 42797778
N-[(2R,3S)-1-hydroxy-3-methylpentan-2-yl]-4-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)butanamide
CID 124864434
methyl 2-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)acetate
CID 79474655
2-(2-aminoethoxy)-N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]acetamide
CID 107863070
2-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)acetamide
CID 173127874
N-[(2R)-1-hydroxy-3-phenylpropan-2-yl]-2-methoxyacetamide
CID 101173549
1,1-difluoro-3-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)propan-2-one
CID 55203346
benzyl N-[2-oxo-2-[2-[(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)methyl]anilino]ethyl]carbamate
CID 90562603

Frequently Asked Questions

What is the IUPAC name of N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]-2-[(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)methoxy]acetamide?
The IUPAC name of N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]-2-[(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)methoxy]acetamide (CID 97457797) is N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]-2-[(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)methoxy]acetamide.
What is the SMILES notation for N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]-2-[(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)methoxy]acetamide?
The canonical SMILES for N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]-2-[(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)methoxy]acetamide is O=C(COCc1nc(-c2cccnc2)no1)N[C@H](CO)Cc1ccccc1.
What is the InChIKey of N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]-2-[(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)methoxy]acetamide?
The InChIKey is DOGWUYMPEUVZHT-INIZCTEOSA-N. The full InChI is InChI=1S/C19H20N4O4/c24-11-16(9-14-5-2-1-3-6-14)21-17(25)12-26-13-18-22-19(23-27-18)15-7-4-8-20-10-15/h1-8,10,16,24H,9,11-13H2,(H,21,25)/t16-/m0/s1.
What are the key properties of N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]-2-[(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)methoxy]acetamide?
N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]-2-[(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)methoxy]acetamide has a molecular weight of 368.39 g/mol, XLogP of 1.37, 9 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]-2-[(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)methoxy]acetamide is sourced from PubChem (CID 97457797), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).