N-methoxy-2,5-dimethylfuran-3-carboxamide

C8H11NO3 — CID 60716938

IUPACN-methoxy-2,5-dimethylfuran-3-carboxamide
SMILESCONC(=O)c1cc(C)oc1C
InChIInChI=1S/C8H11NO3/c1-5-4-7(6(2)12-5)8(10)9-11-3/h4H,1-3H3,(H,9,10)
InChIKeyKOCNVDMXAMNDCJ-UHFFFAOYSA-N
MW169.18 g/mol
LogP1.19
Rot. Bonds2

About N-methoxy-2,5-dimethylfuran-3-carboxamide

N-methoxy-2,5-dimethylfuran-3-carboxamide (PubChem CID 60716938) has the molecular formula C8H11NO3 and a molecular weight of 169.18 g/mol. Its IUPAC name is N-methoxy-2,5-dimethylfuran-3-carboxamide.

Molecular Properties

Compound NameN-methoxy-2,5-dimethylfuran-3-carboxamide
PubChem CID60716938
Molecular FormulaC8H11NO3
Molecular Weight169.18 g/mol
Exact Mass169.07
IUPAC NameN-methoxy-2,5-dimethylfuran-3-carboxamide
SMILESCONC(=O)c1cc(C)oc1C
InChIInChI=1S/C8H11NO3/c1-5-4-7(6(2)12-5)8(10)9-11-3/h4H,1-3H3,(H,9,10)
InChIKeyKOCNVDMXAMNDCJ-UHFFFAOYSA-N
XLogP1.19
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.18
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N'-(2-methoxyacetyl)-2,5-dimethylfuran-3-carbohydrazide
CID 47102396
methyl 3-(2,5-dimethylfuran-3-yl)-3-oxopropanoate
CID 79679462
methyl 2-[(2,5-dimethylfuran-3-carbonyl)amino]-2-methylpropanoate
CID 3858480
N-(4-amino-2-methoxyphenyl)-2,5-dimethylfuran-3-carboxamide
CID 16790725
ethyl 2-[(2,5-dimethylfuran-3-carbonyl)amino]propanoate
CID 61343316
N-[2-[methoxy(methyl)amino]-2-oxoethyl]-2,5-dimethylfuran-3-carboxamide
CID 47301051
N-[(4-aminocyclohexyl)methyl]-2,5-dimethylfuran-3-carboxamide
CID 106124578
2,5-dimethyl-N-(3-methylbutan-2-yl)furan-3-carboxamide
CID 18712127
N-[2-[(2-chloroacetyl)amino]ethyl]-2,5-dimethylfuran-3-carboxamide
CID 166429368
N-(2-amino-2-sulfanylideneethyl)-2,5-dimethylfuran-3-carboxamide
CID 61127079
N-(2-methoxypyrimidin-5-yl)-2,5-dimethylfuran-3-carboxamide
CID 122301541
6-(2,5-dimethylfuran-3-yl)-N-methoxy-3-methyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
CID 33103458

Frequently Asked Questions

What is the IUPAC name of N-methoxy-2,5-dimethylfuran-3-carboxamide?
The IUPAC name of N-methoxy-2,5-dimethylfuran-3-carboxamide (CID 60716938) is N-methoxy-2,5-dimethylfuran-3-carboxamide.
What is the SMILES notation for N-methoxy-2,5-dimethylfuran-3-carboxamide?
The canonical SMILES for N-methoxy-2,5-dimethylfuran-3-carboxamide is CONC(=O)c1cc(C)oc1C.
What is the InChIKey of N-methoxy-2,5-dimethylfuran-3-carboxamide?
The InChIKey is KOCNVDMXAMNDCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11NO3/c1-5-4-7(6(2)12-5)8(10)9-11-3/h4H,1-3H3,(H,9,10).
What are the key properties of N-methoxy-2,5-dimethylfuran-3-carboxamide?
N-methoxy-2,5-dimethylfuran-3-carboxamide has a molecular weight of 169.18 g/mol, XLogP of 1.19, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methoxy-2,5-dimethylfuran-3-carboxamide is sourced from PubChem (CID 60716938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).