N-[2-[methoxy(methyl)amino]-2-oxoethyl]-2,5-dimethylfuran-3-carboxamide

C11H16N2O4 — CID 47301051

IUPACN-[2-[methoxy(methyl)amino]-2-oxoethyl]-2,5-dimethylfuran-3-carboxamide
SMILESCON(C)C(=O)CNC(=O)c1cc(C)oc1C
InChIInChI=1S/C11H16N2O4/c1-7-5-9(8(2)17-7)11(15)12-6-10(14)13(3)16-4/h5H,6H2,1-4H3,(H,12,15)
InChIKeyZAHMXMUJGMEFDV-UHFFFAOYSA-N
MW240.26 g/mol
LogP0.65
Rot. Bonds4

About N-[2-[methoxy(methyl)amino]-2-oxoethyl]-2,5-dimethylfuran-3-carboxamide

N-[2-[methoxy(methyl)amino]-2-oxoethyl]-2,5-dimethylfuran-3-carboxamide (PubChem CID 47301051) has the molecular formula C11H16N2O4 and a molecular weight of 240.26 g/mol. Its IUPAC name is N-[2-[methoxy(methyl)amino]-2-oxoethyl]-2,5-dimethylfuran-3-carboxamide.

Molecular Properties

Compound NameN-[2-[methoxy(methyl)amino]-2-oxoethyl]-2,5-dimethylfuran-3-carboxamide
PubChem CID47301051
Molecular FormulaC11H16N2O4
Molecular Weight240.26 g/mol
Exact Mass240.11
IUPAC NameN-[2-[methoxy(methyl)amino]-2-oxoethyl]-2,5-dimethylfuran-3-carboxamide
SMILESCON(C)C(=O)CNC(=O)c1cc(C)oc1C
InChIInChI=1S/C11H16N2O4/c1-7-5-9(8(2)17-7)11(15)12-6-10(14)13(3)16-4/h5H,6H2,1-4H3,(H,12,15)
InChIKeyZAHMXMUJGMEFDV-UHFFFAOYSA-N
XLogP0.65
TPSA71.78 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.26
LogP ≤ 50.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-(2-amino-2-sulfanylideneethyl)-2,5-dimethylfuran-3-carboxamide
CID 61127079
N-methoxy-2,5-dimethylfuran-3-carboxamide
CID 60716938
2,5-dimethyl-N-[2-[methyl-[2-(4-methylanilino)-2-oxoethyl]amino]-2-oxoethyl]furan-3-carboxamide
CID 55876090
2,5-dimethyl-N-[2-[methyl-(2-methylsulfanylcyclopentyl)amino]-2-oxoethyl]furan-3-carboxamide
CID 71849148
2,5-dimethyl-N-prop-2-enylfuran-3-carboxamide
CID 60653753
N-[2-[(2-chloroacetyl)amino]ethyl]-2,5-dimethylfuran-3-carboxamide
CID 166429368
2-[(2,5-dimethylfuran-3-carbonyl)amino]ethyl-dimethylazanium
CID 7346584
2,5-dimethyl-N-(3-methylbutyl)furan-3-carboxamide
CID 35523982
N-(3-chloropropyl)-2,5-dimethylfuran-3-carboxamide
CID 17165083
N'-(2-methoxyacetyl)-2,5-dimethylfuran-3-carbohydrazide
CID 47102396
N-[(4-aminocyclohexyl)methyl]-2,5-dimethylfuran-3-carboxamide
CID 106124578
methyl 5-[[(2,5-dimethylfuran-3-carbonyl)-methylamino]methyl]-2-methylfuran-3-carboxylate
CID 34484533

Frequently Asked Questions

What is the IUPAC name of N-[2-[methoxy(methyl)amino]-2-oxoethyl]-2,5-dimethylfuran-3-carboxamide?
The IUPAC name of N-[2-[methoxy(methyl)amino]-2-oxoethyl]-2,5-dimethylfuran-3-carboxamide (CID 47301051) is N-[2-[methoxy(methyl)amino]-2-oxoethyl]-2,5-dimethylfuran-3-carboxamide.
What is the SMILES notation for N-[2-[methoxy(methyl)amino]-2-oxoethyl]-2,5-dimethylfuran-3-carboxamide?
The canonical SMILES for N-[2-[methoxy(methyl)amino]-2-oxoethyl]-2,5-dimethylfuran-3-carboxamide is CON(C)C(=O)CNC(=O)c1cc(C)oc1C.
What is the InChIKey of N-[2-[methoxy(methyl)amino]-2-oxoethyl]-2,5-dimethylfuran-3-carboxamide?
The InChIKey is ZAHMXMUJGMEFDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O4/c1-7-5-9(8(2)17-7)11(15)12-6-10(14)13(3)16-4/h5H,6H2,1-4H3,(H,12,15).
What are the key properties of N-[2-[methoxy(methyl)amino]-2-oxoethyl]-2,5-dimethylfuran-3-carboxamide?
N-[2-[methoxy(methyl)amino]-2-oxoethyl]-2,5-dimethylfuran-3-carboxamide has a molecular weight of 240.26 g/mol, XLogP of 0.65, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[methoxy(methyl)amino]-2-oxoethyl]-2,5-dimethylfuran-3-carboxamide is sourced from PubChem (CID 47301051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).