2-amino-N-(1,2,4-oxadiazol-3-ylmethyl)-2-phenylacetamide

C11H12N4O2 — CID 106397092

IUPAC2-amino-N-(1,2,4-oxadiazol-3-ylmethyl)-2-phenylacetamide
SMILESNC(C(=O)NCc1ncon1)c1ccccc1
InChIInChI=1S/C11H12N4O2/c12-10(8-4-2-1-3-5-8)11(16)13-6-9-14-7-17-15-9/h1-5,7,10H,6,12H2,(H,13,16)
InChIKeyMZPURAVMIQHCSO-UHFFFAOYSA-N
MW232.24 g/mol
LogP0.39
Rot. Bonds4

About 2-amino-N-(1,2,4-oxadiazol-3-ylmethyl)-2-phenylacetamide

2-amino-N-(1,2,4-oxadiazol-3-ylmethyl)-2-phenylacetamide (PubChem CID 106397092) has the molecular formula C11H12N4O2 and a molecular weight of 232.24 g/mol. Its IUPAC name is 2-amino-N-(1,2,4-oxadiazol-3-ylmethyl)-2-phenylacetamide.

Molecular Properties

Compound Name2-amino-N-(1,2,4-oxadiazol-3-ylmethyl)-2-phenylacetamide
PubChem CID106397092
Molecular FormulaC11H12N4O2
Molecular Weight232.24 g/mol
Exact Mass232.10
IUPAC Name2-amino-N-(1,2,4-oxadiazol-3-ylmethyl)-2-phenylacetamide
SMILESNC(C(=O)NCc1ncon1)c1ccccc1
InChIInChI=1S/C11H12N4O2/c12-10(8-4-2-1-3-5-8)11(16)13-6-9-14-7-17-15-9/h1-5,7,10H,6,12H2,(H,13,16)
InChIKeyMZPURAVMIQHCSO-UHFFFAOYSA-N
XLogP0.39
TPSA94.04 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.24
LogP ≤ 50.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-amino-N-(1,2,4-oxadiazol-3-ylmethyl)-2-phenyl-3-sulfanylidenepropanamide
CID 106399276
(2S)-2-amino-N-(1,2,4-oxadiazol-3-ylmethyl)butanamide
CID 106397147
(2R)-2-amino-N-[(1-methyl-1,2,4-triazol-3-yl)methyl]-2-phenylacetamide
CID 114125272
ethyl 2-(1,2,4-oxadiazol-3-ylmethylamino)-2-phenylacetate
CID 114184126
3-amino-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]-2-phenylpropanamide
CID 106397844
2-bromo-N-(1,2,4-oxadiazol-3-ylmethyl)propanamide
CID 106395520
5-[[[(2R)-2-amino-2-phenylacetyl]amino]methyl]pyridine-2-carboxylic acid
CID 81089954
3-(2-aminophenoxy)-N-(1,2,4-oxadiazol-3-ylmethyl)propanamide
CID 106391378
2-(1,2,4-oxadiazol-3-ylmethylamino)-2-oxoacetic acid
CID 106406078
(2S)-2-amino-N-[(3-methyl-1,2-oxazol-5-yl)methyl]-2-phenylacetamide
CID 104897754
(2R)-2-amino-N-(1H-imidazol-2-ylmethyl)-2-phenylacetamide
CID 64529573
(2R)-2-amino-N-[(4-hydroxyphenyl)methyl]-2-phenylacetamide
CID 96927089

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(1,2,4-oxadiazol-3-ylmethyl)-2-phenylacetamide?
The IUPAC name of 2-amino-N-(1,2,4-oxadiazol-3-ylmethyl)-2-phenylacetamide (CID 106397092) is 2-amino-N-(1,2,4-oxadiazol-3-ylmethyl)-2-phenylacetamide.
What is the SMILES notation for 2-amino-N-(1,2,4-oxadiazol-3-ylmethyl)-2-phenylacetamide?
The canonical SMILES for 2-amino-N-(1,2,4-oxadiazol-3-ylmethyl)-2-phenylacetamide is NC(C(=O)NCc1ncon1)c1ccccc1.
What is the InChIKey of 2-amino-N-(1,2,4-oxadiazol-3-ylmethyl)-2-phenylacetamide?
The InChIKey is MZPURAVMIQHCSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N4O2/c12-10(8-4-2-1-3-5-8)11(16)13-6-9-14-7-17-15-9/h1-5,7,10H,6,12H2,(H,13,16).
What are the key properties of 2-amino-N-(1,2,4-oxadiazol-3-ylmethyl)-2-phenylacetamide?
2-amino-N-(1,2,4-oxadiazol-3-ylmethyl)-2-phenylacetamide has a molecular weight of 232.24 g/mol, XLogP of 0.39, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(1,2,4-oxadiazol-3-ylmethyl)-2-phenylacetamide is sourced from PubChem (CID 106397092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).