N-[3-[[2-(5-oxo-3-phenyl-1,2,4-oxadiazol-4-yl)acetyl]amino]phenyl]propanamide

C19H18N4O4 — CID 1435028

IUPACN-[3-[[2-(5-oxo-3-phenyl-1,2,4-oxadiazol-4-yl)acetyl]amino]phenyl]propanamide
SMILESCCC(=O)Nc1cccc(NC(=O)Cn2c(-c3ccccc3)noc2=O)c1
InChIInChI=1S/C19H18N4O4/c1-2-16(24)20-14-9-6-10-15(11-14)21-17(25)12-23-18(22-27-19(23)26)13-7-4-3-5-8-13/h3-11H,2,12H2,1H3,(H,20,24)(H,21,25)
InChIKeyZMUSNEADDJUMCS-UHFFFAOYSA-N
MW366.38 g/mol
LogP2.49
Rot. Bonds6

About N-[3-[[2-(5-oxo-3-phenyl-1,2,4-oxadiazol-4-yl)acetyl]amino]phenyl]propanamide

N-[3-[[2-(5-oxo-3-phenyl-1,2,4-oxadiazol-4-yl)acetyl]amino]phenyl]propanamide (PubChem CID 1435028) has the molecular formula C19H18N4O4 and a molecular weight of 366.38 g/mol. Its IUPAC name is N-[3-[[2-(5-oxo-3-phenyl-1,2,4-oxadiazol-4-yl)acetyl]amino]phenyl]propanamide.

Molecular Properties

Compound NameN-[3-[[2-(5-oxo-3-phenyl-1,2,4-oxadiazol-4-yl)acetyl]amino]phenyl]propanamide
PubChem CID1435028
Molecular FormulaC19H18N4O4
Molecular Weight366.38 g/mol
Exact Mass366.13
IUPAC NameN-[3-[[2-(5-oxo-3-phenyl-1,2,4-oxadiazol-4-yl)acetyl]amino]phenyl]propanamide
SMILESCCC(=O)Nc1cccc(NC(=O)Cn2c(-c3ccccc3)noc2=O)c1
InChIInChI=1S/C19H18N4O4/c1-2-16(24)20-14-9-6-10-15(11-14)21-17(25)12-23-18(22-27-19(23)26)13-7-4-3-5-8-13/h3-11H,2,12H2,1H3,(H,20,24)(H,21,25)
InChIKeyZMUSNEADDJUMCS-UHFFFAOYSA-N
XLogP2.49
TPSA106.23 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.38
LogP ≤ 52.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-[1-(furan-2-yl)ethyl]-2-(5-oxo-3-phenyl-1,2,4-oxadiazol-4-yl)acetamide
CID 71935095
N-[(2,4-dimethylphenyl)carbamoyl]-2-(5-oxo-3-phenyl-1,2,4-oxadiazol-4-yl)acetamide
CID 48729981
ethyl 5-ethyl-2-[[2-(5-oxo-3-phenyl-1,2,4-oxadiazol-4-yl)acetyl]amino]thiophene-3-carboxylate
CID 60589909
N-[(3-methoxyphenyl)methyl]-2-(5-oxo-3-phenyl-1,2,4-oxadiazol-4-yl)acetamide
CID 49153048
N-(3-acetylphenyl)-2-(5-oxo-3-propan-2-yl-1,2,4-oxadiazol-4-yl)acetamide
CID 146082832
N-[4-[2-(5-oxo-3-phenyl-1,2,4-oxadiazol-4-yl)acetyl]phenyl]benzamide
CID 48730150
3-[(5-oxo-3-phenyl-1,2,4-oxadiazol-4-yl)methyl]-N-phenylbenzamide
CID 71881498
N-[(2-chlorophenyl)methylideneamino]-2-(5-oxo-3-phenyl-1,2,4-oxadiazol-4-yl)acetamide
CID 4155202
N-[(3S)-5-methyl-2-oxo-1-(5-oxo-3-phenyl-1,2,4-oxadiazol-4-yl)hexan-3-yl]benzamide
CID 20791350
N-(4-acetylphenyl)-2-(5-oxo-3-thiophen-2-yl-1,2,4-oxadiazol-4-yl)acetamide
CID 51099628
2-[2-(3-methyl-1,2,4-oxadiazol-5-yl)-6-oxo-1-pyridinyl]-N-phenylacetamide
CID 53141456
N-(3,5-dimethylphenyl)-2-(4-ethyl-6-oxo-2-phenylpyrimidin-1-yl)acetamide
CID 91887464

Frequently Asked Questions

What is the IUPAC name of N-[3-[[2-(5-oxo-3-phenyl-1,2,4-oxadiazol-4-yl)acetyl]amino]phenyl]propanamide?
The IUPAC name of N-[3-[[2-(5-oxo-3-phenyl-1,2,4-oxadiazol-4-yl)acetyl]amino]phenyl]propanamide (CID 1435028) is N-[3-[[2-(5-oxo-3-phenyl-1,2,4-oxadiazol-4-yl)acetyl]amino]phenyl]propanamide.
What is the SMILES notation for N-[3-[[2-(5-oxo-3-phenyl-1,2,4-oxadiazol-4-yl)acetyl]amino]phenyl]propanamide?
The canonical SMILES for N-[3-[[2-(5-oxo-3-phenyl-1,2,4-oxadiazol-4-yl)acetyl]amino]phenyl]propanamide is CCC(=O)Nc1cccc(NC(=O)Cn2c(-c3ccccc3)noc2=O)c1.
What is the InChIKey of N-[3-[[2-(5-oxo-3-phenyl-1,2,4-oxadiazol-4-yl)acetyl]amino]phenyl]propanamide?
The InChIKey is ZMUSNEADDJUMCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N4O4/c1-2-16(24)20-14-9-6-10-15(11-14)21-17(25)12-23-18(22-27-19(23)26)13-7-4-3-5-8-13/h3-11H,2,12H2,1H3,(H,20,24)(H,21,25).
What are the key properties of N-[3-[[2-(5-oxo-3-phenyl-1,2,4-oxadiazol-4-yl)acetyl]amino]phenyl]propanamide?
N-[3-[[2-(5-oxo-3-phenyl-1,2,4-oxadiazol-4-yl)acetyl]amino]phenyl]propanamide has a molecular weight of 366.38 g/mol, XLogP of 2.49, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[[2-(5-oxo-3-phenyl-1,2,4-oxadiazol-4-yl)acetyl]amino]phenyl]propanamide is sourced from PubChem (CID 1435028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).