N-[[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]methyl]-1-(2-methoxyethyl)-4,6-dimethyl-2-oxopyridine-3-carboxamide

C18H20N4O5 — CID 91821037

IUPACN-[[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]methyl]-1-(2-methoxyethyl)-4,6-dimethyl-2-oxopyridine-3-carboxamide
SMILESCOCCn1c(C)cc(C)c(C(=O)NCc2nc(-c3ccco3)no2)c1=O
InChIInChI=1S/C18H20N4O5/c1-11-9-12(2)22(6-8-25-3)18(24)15(11)17(23)19-10-14-20-16(21-27-14)13-5-4-7-26-13/h4-5,7,9H,6,8,10H2,1-3H3,(H,19,23)
InChIKeyWARIUZVNJZVSAG-UHFFFAOYSA-N
MW372.38 g/mol
LogP1.68
Rot. Bonds7

About N-[[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]methyl]-1-(2-methoxyethyl)-4,6-dimethyl-2-oxopyridine-3-carboxamide

N-[[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]methyl]-1-(2-methoxyethyl)-4,6-dimethyl-2-oxopyridine-3-carboxamide (PubChem CID 91821037) has the molecular formula C18H20N4O5 and a molecular weight of 372.38 g/mol. Its IUPAC name is N-[[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]methyl]-1-(2-methoxyethyl)-4,6-dimethyl-2-oxopyridine-3-carboxamide.

Molecular Properties

Compound NameN-[[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]methyl]-1-(2-methoxyethyl)-4,6-dimethyl-2-oxopyridine-3-carboxamide
PubChem CID91821037
Molecular FormulaC18H20N4O5
Molecular Weight372.38 g/mol
Exact Mass372.14
IUPAC NameN-[[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]methyl]-1-(2-methoxyethyl)-4,6-dimethyl-2-oxopyridine-3-carboxamide
SMILESCOCCn1c(C)cc(C)c(C(=O)NCc2nc(-c3ccco3)no2)c1=O
InChIInChI=1S/C18H20N4O5/c1-11-9-12(2)22(6-8-25-3)18(24)15(11)17(23)19-10-14-20-16(21-27-14)13-5-4-7-26-13/h4-5,7,9H,6,8,10H2,1-3H3,(H,19,23)
InChIKeyWARIUZVNJZVSAG-UHFFFAOYSA-N
XLogP1.68
TPSA112.39 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.38
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Related Compounds

3-[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]-N-(3-methoxypropyl)propanamide
CID 36741660
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CID 122169858
N-[2-[[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]methyl]phenyl]-3,5-dimethyl-1,2-oxazole-4-carboxamide
CID 86263840
N-[[3-(5-methoxy-3-methyl-1-benzofuran-2-yl)-1,2,4-oxadiazol-5-yl]methyl]furan-2-carboxamide
CID 53126253
3-(furan-2-yl)-N-[(2-methoxyphenyl)methyl]-5-methyl-1,2-oxazole-4-carboxamide
CID 110682416
N-[[3-(3-methyl-2-oxo-1,3-benzoxazol-6-yl)-1,2,4-oxadiazol-5-yl]methyl]furan-2-carboxamide
CID 53139190
(1R)-N-[[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]methyl]-2-methoxy-1-(2-methylpyrazol-3-yl)ethanamine
CID 95144639
3,3,3-trifluoro-2-[[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]methylamino]-2-methylpropanoic acid
CID 79789396
N-[[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]methyl]-2-(4-methylpyrazol-1-yl)ethanamine
CID 56780229
methyl 4-[[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]methyl]morpholine-2-carboxylate
CID 78925869
methyl 4-[[2-[[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]methyl]phenyl]sulfamoyl]benzoate
CID 90563586
1-[[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]methylamino]cyclobutane-1-carboxylic acid
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Frequently Asked Questions

What is the IUPAC name of N-[[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]methyl]-1-(2-methoxyethyl)-4,6-dimethyl-2-oxopyridine-3-carboxamide?
The IUPAC name of N-[[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]methyl]-1-(2-methoxyethyl)-4,6-dimethyl-2-oxopyridine-3-carboxamide (CID 91821037) is N-[[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]methyl]-1-(2-methoxyethyl)-4,6-dimethyl-2-oxopyridine-3-carboxamide.
What is the SMILES notation for N-[[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]methyl]-1-(2-methoxyethyl)-4,6-dimethyl-2-oxopyridine-3-carboxamide?
The canonical SMILES for N-[[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]methyl]-1-(2-methoxyethyl)-4,6-dimethyl-2-oxopyridine-3-carboxamide is COCCn1c(C)cc(C)c(C(=O)NCc2nc(-c3ccco3)no2)c1=O.
What is the InChIKey of N-[[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]methyl]-1-(2-methoxyethyl)-4,6-dimethyl-2-oxopyridine-3-carboxamide?
The InChIKey is WARIUZVNJZVSAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N4O5/c1-11-9-12(2)22(6-8-25-3)18(24)15(11)17(23)19-10-14-20-16(21-27-14)13-5-4-7-26-13/h4-5,7,9H,6,8,10H2,1-3H3,(H,19,23).
What are the key properties of N-[[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]methyl]-1-(2-methoxyethyl)-4,6-dimethyl-2-oxopyridine-3-carboxamide?
N-[[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]methyl]-1-(2-methoxyethyl)-4,6-dimethyl-2-oxopyridine-3-carboxamide has a molecular weight of 372.38 g/mol, XLogP of 1.68, 7 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]methyl]-1-(2-methoxyethyl)-4,6-dimethyl-2-oxopyridine-3-carboxamide is sourced from PubChem (CID 91821037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).