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

C16H15N3O4 — CID 131941260

IUPAC5-(4-methoxyphenyl)-N-[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]furan-2-carboxamide
SMILESCOc1ccc(-c2ccc(C(=O)NCc3nonc3C)o2)cc1
InChIInChI=1S/C16H15N3O4/c1-10-13(19-23-18-10)9-17-16(20)15-8-7-14(22-15)11-3-5-12(21-2)6-4-11/h3-8H,9H2,1-2H3,(H,17,20)
InChIKeyQQJBBPFMEHYLAM-UHFFFAOYSA-N
MW313.31 g/mol
LogP2.58
Rot. Bonds5

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

5-(4-methoxyphenyl)-N-[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]furan-2-carboxamide (PubChem CID 131941260) has the molecular formula C16H15N3O4 and a molecular weight of 313.31 g/mol. Its IUPAC name is 5-(4-methoxyphenyl)-N-[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]furan-2-carboxamide.

Molecular Properties

Compound Name5-(4-methoxyphenyl)-N-[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]furan-2-carboxamide
PubChem CID131941260
Molecular FormulaC16H15N3O4
Molecular Weight313.31 g/mol
Exact Mass313.11
IUPAC Name5-(4-methoxyphenyl)-N-[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]furan-2-carboxamide
SMILESCOc1ccc(-c2ccc(C(=O)NCc3nonc3C)o2)cc1
InChIInChI=1S/C16H15N3O4/c1-10-13(19-23-18-10)9-17-16(20)15-8-7-14(22-15)11-3-5-12(21-2)6-4-11/h3-8H,9H2,1-2H3,(H,17,20)
InChIKeyQQJBBPFMEHYLAM-UHFFFAOYSA-N
XLogP2.58
TPSA90.39 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.31
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[(4-methoxyphenyl)methyl]-4-methyl-1,2,5-oxadiazole-3-carboxamide
CID 110691868
N-(2-aminoethyl)-5-(4-methoxyphenyl)furan-2-carboxamide
CID 94273188
N-[[2-[2-(ethylsulfonylamino)phenyl]-5-methyl-1,3-oxazol-4-yl]methyl]-5-(4-methoxyphenyl)furan-2-carboxamide
CID 42431882
N-[[5-(4-bromophenyl)furan-2-yl]methyl]-2-(4-methoxyphenyl)acetamide
CID 24588403
N-[2-(2-amino-1,3-thiazol-4-yl)ethyl]-5-(4-methoxyphenyl)furan-2-carboxamide
CID 50959187
5-(4-methoxyphenyl)-N-[2-(1H-1,2,4-triazol-5-ylsulfanyl)ethyl]furan-2-carboxamide
CID 131931769
ethyl 4-[[(5-phenylfuran-2-carbonyl)amino]methyl]benzoate
CID 59654810
4-methoxy-N-[[5-(4-methylphenyl)-1,2-oxazol-3-yl]methyl]benzamide
CID 16866605
N-[(3,4-dimethoxyphenyl)methyl]-5-(4-fluorophenyl)furan-2-carboxamide
CID 9082502
5-(4-acetylphenyl)-N-[2-[(4-methoxyphenyl)sulfonylamino]ethyl]furan-2-carboxamide
CID 30755667
N-benzyl-5-(4-methoxyphenyl)-1,3-oxazole-2-carboxamide
CID 16949912
5-(2,4-dichlorophenyl)-N-[(4-methoxyphenyl)methyl]furan-2-carboxamide
CID 51057984

Frequently Asked Questions

What is the IUPAC name of 5-(4-methoxyphenyl)-N-[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]furan-2-carboxamide?
The IUPAC name of 5-(4-methoxyphenyl)-N-[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]furan-2-carboxamide (CID 131941260) is 5-(4-methoxyphenyl)-N-[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]furan-2-carboxamide.
What is the SMILES notation for 5-(4-methoxyphenyl)-N-[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]furan-2-carboxamide?
The canonical SMILES for 5-(4-methoxyphenyl)-N-[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]furan-2-carboxamide is COc1ccc(-c2ccc(C(=O)NCc3nonc3C)o2)cc1.
What is the InChIKey of 5-(4-methoxyphenyl)-N-[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]furan-2-carboxamide?
The InChIKey is QQJBBPFMEHYLAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O4/c1-10-13(19-23-18-10)9-17-16(20)15-8-7-14(22-15)11-3-5-12(21-2)6-4-11/h3-8H,9H2,1-2H3,(H,17,20).
What are the key properties of 5-(4-methoxyphenyl)-N-[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]furan-2-carboxamide?
5-(4-methoxyphenyl)-N-[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]furan-2-carboxamide has a molecular weight of 313.31 g/mol, XLogP of 2.58, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-methoxyphenyl)-N-[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]furan-2-carboxamide is sourced from PubChem (CID 131941260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).