2-(5-phenyl-1,2,4-oxadiazol-3-yl)acetamide

C10H9N3O2 — CID 71279247

IUPAC2-(5-phenyl-1,2,4-oxadiazol-3-yl)acetamide
SMILESNC(=O)Cc1noc(-c2ccccc2)n1
InChIInChI=1S/C10H9N3O2/c11-8(14)6-9-12-10(15-13-9)7-4-2-1-3-5-7/h1-5H,6H2,(H2,11,14)
InChIKeyHQCPQKDZZQQRRJ-UHFFFAOYSA-N
MW203.20 g/mol
LogP0.76
Rot. Bonds3

About 2-(5-phenyl-1,2,4-oxadiazol-3-yl)acetamide

2-(5-phenyl-1,2,4-oxadiazol-3-yl)acetamide (PubChem CID 71279247) has the molecular formula C10H9N3O2 and a molecular weight of 203.20 g/mol. Its IUPAC name is 2-(5-phenyl-1,2,4-oxadiazol-3-yl)acetamide.

Molecular Properties

Compound Name2-(5-phenyl-1,2,4-oxadiazol-3-yl)acetamide
PubChem CID71279247
Molecular FormulaC10H9N3O2
Molecular Weight203.20 g/mol
Exact Mass203.07
IUPAC Name2-(5-phenyl-1,2,4-oxadiazol-3-yl)acetamide
SMILESNC(=O)Cc1noc(-c2ccccc2)n1
InChIInChI=1S/C10H9N3O2/c11-8(14)6-9-12-10(15-13-9)7-4-2-1-3-5-7/h1-5H,6H2,(H2,11,14)
InChIKeyHQCPQKDZZQQRRJ-UHFFFAOYSA-N
XLogP0.76
TPSA82.01 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.20
LogP ≤ 50.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(5-phenyl-1,2,4-oxadiazol-3-yl)methanesulfinic acid
CID 59944372
3-ethyl-5-phenyl-1,2,4-oxadiazole
CID 20678688
3-(methoxymethyl)-5-phenyl-1,2,4-oxadiazole
CID 59009688
N-hydroxy-4-[(5-phenyl-1,2,4-oxadiazol-3-yl)methyl]benzamide
CID 135358206
2-[tert-butyl-[(5-phenyl-1,2,4-oxadiazol-3-yl)methyl]amino]acetic acid
CID 79263003
2-[(5-phenyl-1,2,4-oxadiazol-3-yl)methyl-propan-2-ylamino]acetic acid
CID 60839651
2-[5-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-3-yl]acetic acid
CID 3492218
2-[ethyl-[(5-phenyl-1,2,4-oxadiazol-3-yl)methyl]amino]-2-methylpropanoic acid
CID 62819926
3-[(5-phenyl-1,2,4-oxadiazol-3-yl)methylsulfanyl]butanoic acid
CID 66138702
3,3-dimethyl-N-[(5-phenyl-1,2,4-oxadiazol-3-yl)methyl]butanamide
CID 53098234
2,6-difluoro-3-[(5-phenyl-1,2,4-oxadiazol-3-yl)methoxy]benzamide
CID 59402902
2-[(5-phenyl-1,2,4-oxadiazol-3-yl)methylsulfanyl]ethanamine
CID 43249503

Frequently Asked Questions

What is the IUPAC name of 2-(5-phenyl-1,2,4-oxadiazol-3-yl)acetamide?
The IUPAC name of 2-(5-phenyl-1,2,4-oxadiazol-3-yl)acetamide (CID 71279247) is 2-(5-phenyl-1,2,4-oxadiazol-3-yl)acetamide.
What is the SMILES notation for 2-(5-phenyl-1,2,4-oxadiazol-3-yl)acetamide?
The canonical SMILES for 2-(5-phenyl-1,2,4-oxadiazol-3-yl)acetamide is NC(=O)Cc1noc(-c2ccccc2)n1.
What is the InChIKey of 2-(5-phenyl-1,2,4-oxadiazol-3-yl)acetamide?
The InChIKey is HQCPQKDZZQQRRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9N3O2/c11-8(14)6-9-12-10(15-13-9)7-4-2-1-3-5-7/h1-5H,6H2,(H2,11,14).
What are the key properties of 2-(5-phenyl-1,2,4-oxadiazol-3-yl)acetamide?
2-(5-phenyl-1,2,4-oxadiazol-3-yl)acetamide has a molecular weight of 203.20 g/mol, XLogP of 0.76, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-phenyl-1,2,4-oxadiazol-3-yl)acetamide is sourced from PubChem (CID 71279247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).