2,5-dimethylfuran-3,4-dicarboxamide

C8H10N2O3 — CID 650496

IUPAC2,5-dimethylfuran-3,4-dicarboxamide
SMILESCc1oc(C)c(C(N)=O)c1C(N)=O
InChIInChI=1S/C8H10N2O3/c1-3-5(7(9)11)6(8(10)12)4(2)13-3/h1-2H3,(H2,9,11)(H2,10,12)
InChIKeyWXPLCAAIRDJMFJ-UHFFFAOYSA-N
MW182.18 g/mol
LogP0.09
Rot. Bonds2

About 2,5-dimethylfuran-3,4-dicarboxamide

2,5-dimethylfuran-3,4-dicarboxamide (PubChem CID 650496) has the molecular formula C8H10N2O3 and a molecular weight of 182.18 g/mol. Its IUPAC name is 2,5-dimethylfuran-3,4-dicarboxamide.

Molecular Properties

Compound Name2,5-dimethylfuran-3,4-dicarboxamide
PubChem CID650496
Molecular FormulaC8H10N2O3
Molecular Weight182.18 g/mol
Exact Mass182.07
IUPAC Name2,5-dimethylfuran-3,4-dicarboxamide
SMILESCc1oc(C)c(C(N)=O)c1C(N)=O
InChIInChI=1S/C8H10N2O3/c1-3-5(7(9)11)6(8(10)12)4(2)13-3/h1-2H3,(H2,9,11)(H2,10,12)
InChIKeyWXPLCAAIRDJMFJ-UHFFFAOYSA-N
XLogP0.09
TPSA99.32 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.18
LogP ≤ 50.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-(Tert-butyl)-2-methyl-3-furamide
CID 704149
2,5-Dimethylfuran-3-carbohydrazide
CID 2360209
4-(Aminomethyl)-2,5-dimethyl-3-furoic acid
CID 686825
5-Methyl-2-(trifluoromethyl)furan-3-carboxamide
CID 2775640
2-Methyl-5-(2-methylpropyl)furan-3-carboxamide
CID 674000
Benzofurane-3-carboxamide, 4,5,6,7-tetrahydro-2-methyl-
CID 601519
2,5-Dimethyl-3-furamide
CID 4559414
Ethyl 4-(aminomethyl)-2,5-dimethylfuran-3-carboxylate
CID 591699
2-Amino-4,5-dimethylfuran-3-carboxamide
CID 290213
2-Methylfuran-3-carboxamide
CID 10772974
(4-Ethylpiperazin-1-yl)-(2,4,5-trimethylfuran-3-yl)methanone
CID 40055119
N-diaminophosphoryl-5-methyl-2-(trifluoromethyl)furan-3-carboxamide
CID 18938043

Frequently Asked Questions

What is the IUPAC name of 2,5-dimethylfuran-3,4-dicarboxamide?
The IUPAC name of 2,5-dimethylfuran-3,4-dicarboxamide (CID 650496) is 2,5-dimethylfuran-3,4-dicarboxamide.
What is the SMILES notation for 2,5-dimethylfuran-3,4-dicarboxamide?
The canonical SMILES for 2,5-dimethylfuran-3,4-dicarboxamide is Cc1oc(C)c(C(N)=O)c1C(N)=O.
What is the InChIKey of 2,5-dimethylfuran-3,4-dicarboxamide?
The InChIKey is WXPLCAAIRDJMFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2O3/c1-3-5(7(9)11)6(8(10)12)4(2)13-3/h1-2H3,(H2,9,11)(H2,10,12).
What are the key properties of 2,5-dimethylfuran-3,4-dicarboxamide?
2,5-dimethylfuran-3,4-dicarboxamide has a molecular weight of 182.18 g/mol, XLogP of 0.09, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethylfuran-3,4-dicarboxamide is sourced from PubChem (CID 650496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).