N-[4-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]phenyl]furan-3-carboxamide

C20H15N3O3 — CID 46392010

IUPACN-[4-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]phenyl]furan-3-carboxamide
SMILESO=C(Nc1ccc(Cc2nc(-c3ccccc3)no2)cc1)c1ccoc1
InChIInChI=1S/C20H15N3O3/c24-20(16-10-11-25-13-16)21-17-8-6-14(7-9-17)12-18-22-19(23-26-18)15-4-2-1-3-5-15/h1-11,13H,12H2,(H,21,24)
InChIKeyVPICEWSODSRZHV-UHFFFAOYSA-N
MW345.36 g/mol
LogP4.17
Rot. Bonds5

About N-[4-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]phenyl]furan-3-carboxamide

N-[4-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]phenyl]furan-3-carboxamide (PubChem CID 46392010) has the molecular formula C20H15N3O3 and a molecular weight of 345.36 g/mol. Its IUPAC name is N-[4-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]phenyl]furan-3-carboxamide.

Molecular Properties

Compound NameN-[4-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]phenyl]furan-3-carboxamide
PubChem CID46392010
Molecular FormulaC20H15N3O3
Molecular Weight345.36 g/mol
Exact Mass345.11
IUPAC NameN-[4-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]phenyl]furan-3-carboxamide
SMILESO=C(Nc1ccc(Cc2nc(-c3ccccc3)no2)cc1)c1ccoc1
InChIInChI=1S/C20H15N3O3/c24-20(16-10-11-25-13-16)21-17-8-6-14(7-9-17)12-18-22-19(23-26-18)15-4-2-1-3-5-15/h1-11,13H,12H2,(H,21,24)
InChIKeyVPICEWSODSRZHV-UHFFFAOYSA-N
XLogP4.17
TPSA81.16 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.36
LogP ≤ 54.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[4-(5-benzyl-1,2,4-oxadiazol-3-yl)phenyl]-4-fluorobenzamide
CID 17052840
N-[4-[5-[(4-chlorophenyl)methyl]-1,2,4-oxadiazol-3-yl]phenyl]pyridine-2-carboxamide
CID 122176663
5-benzyl-3-phenyl-1,2,4-oxadiazole
CID 752274
(3-phenyl-1,2,4-oxadiazol-5-yl)methyl furan-3-carboxylate
CID 26985153
N-[4-(methylaminomethyl)phenyl]furan-3-carboxamide
CID 106909959
3-(4-methylphenyl)-5-[(4-phenylphenyl)methyl]-1,2,4-oxadiazole
CID 8895143
N-[2-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]phenyl]furan-3-carboxamide
CID 90563812
3-(3-phenyl-1,2,4-oxadiazol-5-yl)-N-(4-phenylphenyl)propanamide
CID 9192093
N-(4-acetylphenyl)-4-(3-phenyl-1,2,4-oxadiazol-5-yl)benzamide
CID 46385460
N-(4-methylphenyl)-3-[3-(4-phenylphenyl)-1,2,4-oxadiazol-5-yl]propanamide
CID 100762262
2-(3-phenyl-1,2,4-oxadiazol-5-yl)acetic acid
CID 7017713
3-(4-methoxyphenyl)-5-[(4-phenylphenyl)methyl]-1,2,4-oxadiazole
CID 8895154

Frequently Asked Questions

What is the IUPAC name of N-[4-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]phenyl]furan-3-carboxamide?
The IUPAC name of N-[4-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]phenyl]furan-3-carboxamide (CID 46392010) is N-[4-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]phenyl]furan-3-carboxamide.
What is the SMILES notation for N-[4-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]phenyl]furan-3-carboxamide?
The canonical SMILES for N-[4-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]phenyl]furan-3-carboxamide is O=C(Nc1ccc(Cc2nc(-c3ccccc3)no2)cc1)c1ccoc1.
What is the InChIKey of N-[4-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]phenyl]furan-3-carboxamide?
The InChIKey is VPICEWSODSRZHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15N3O3/c24-20(16-10-11-25-13-16)21-17-8-6-14(7-9-17)12-18-22-19(23-26-18)15-4-2-1-3-5-15/h1-11,13H,12H2,(H,21,24).
What are the key properties of N-[4-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]phenyl]furan-3-carboxamide?
N-[4-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]phenyl]furan-3-carboxamide has a molecular weight of 345.36 g/mol, XLogP of 4.17, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]phenyl]furan-3-carboxamide is sourced from PubChem (CID 46392010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).