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

C18H19N3O4 — CID 26172473

IUPACN-[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl]-4-methoxy-N-propylbenzamide
SMILESCCCN(Cc1nnc(-c2ccco2)o1)C(=O)c1ccc(OC)cc1
InChIInChI=1S/C18H19N3O4/c1-3-10-21(18(22)13-6-8-14(23-2)9-7-13)12-16-19-20-17(25-16)15-5-4-11-24-15/h4-9,11H,3,10,12H2,1-2H3
InChIKeyLBFLWZBRPIGYPW-UHFFFAOYSA-N
MW341.37 g/mol
LogP3.39
Rot. Bonds7

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

N-[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl]-4-methoxy-N-propylbenzamide (PubChem CID 26172473) has the molecular formula C18H19N3O4 and a molecular weight of 341.37 g/mol. Its IUPAC name is N-[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl]-4-methoxy-N-propylbenzamide.

Molecular Properties

Compound NameN-[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl]-4-methoxy-N-propylbenzamide
PubChem CID26172473
Molecular FormulaC18H19N3O4
Molecular Weight341.37 g/mol
Exact Mass341.14
IUPAC NameN-[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl]-4-methoxy-N-propylbenzamide
SMILESCCCN(Cc1nnc(-c2ccco2)o1)C(=O)c1ccc(OC)cc1
InChIInChI=1S/C18H19N3O4/c1-3-10-21(18(22)13-6-8-14(23-2)9-7-13)12-16-19-20-17(25-16)15-5-4-11-24-15/h4-9,11H,3,10,12H2,1-2H3
InChIKeyLBFLWZBRPIGYPW-UHFFFAOYSA-N
XLogP3.39
TPSA81.60 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.37
LogP ≤ 53.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

N-[4-[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl-propylcarbamoyl]phenyl]thiophene-2-carboxamide
CID 32569182
1-benzyl-N-[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl]-N-propylpyrazole-4-carboxamide
CID 32569655
2-(4-chlorophenyl)-N-[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl]-4-methyl-N-propyl-1,3-thiazole-5-carboxamide
CID 32570401
2-[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl-propylamino]-N-(propylcarbamoyl)acetamide
CID 9370842
N-(4-ethoxyphenyl)-2-[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl-propylamino]acetamide
CID 9371596
(E)-3-(2-fluorophenyl)-N-[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl]-N-propylprop-2-enamide
CID 43009982
N-(3,4-dimethoxyphenyl)-2-[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl-propylamino]acetamide
CID 9371528
ethyl 4-[[2-[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl-propylamino]acetyl]amino]benzoate
CID 9371489
2-[[2-[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl-propylamino]acetyl]amino]-N-propylacetamide
CID 8689520
(E)-3-(3-bromophenyl)-N-[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl]-N-propylprop-2-enamide
CID 43009965
methyl 2-[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl-methylamino]acetate
CID 60670446
2-[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl-propylamino]-1-(6-methoxy-3,4-dihydro-2H-quinolin-1-yl)ethanone
CID 18131392

Frequently Asked Questions

What is the IUPAC name of N-[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl]-4-methoxy-N-propylbenzamide?
The IUPAC name of N-[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl]-4-methoxy-N-propylbenzamide (CID 26172473) is N-[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl]-4-methoxy-N-propylbenzamide.
What is the SMILES notation for N-[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl]-4-methoxy-N-propylbenzamide?
The canonical SMILES for N-[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl]-4-methoxy-N-propylbenzamide is CCCN(Cc1nnc(-c2ccco2)o1)C(=O)c1ccc(OC)cc1.
What is the InChIKey of N-[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl]-4-methoxy-N-propylbenzamide?
The InChIKey is LBFLWZBRPIGYPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O4/c1-3-10-21(18(22)13-6-8-14(23-2)9-7-13)12-16-19-20-17(25-16)15-5-4-11-24-15/h4-9,11H,3,10,12H2,1-2H3.
What are the key properties of N-[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl]-4-methoxy-N-propylbenzamide?
N-[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl]-4-methoxy-N-propylbenzamide has a molecular weight of 341.37 g/mol, XLogP of 3.39, 7 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl]-4-methoxy-N-propylbenzamide is sourced from PubChem (CID 26172473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).