3-methylfuran-2-carboxamide

C6H7NO2 — CID 10725345

IUPAC3-methylfuran-2-carboxamide
SMILESCc1ccoc1C(N)=O
InChIInChI=1S/C6H7NO2/c1-4-2-3-9-5(4)6(7)8/h2-3H,1H3,(H2,7,8)
InChIKeyRDQSAEZUEUFCFX-UHFFFAOYSA-N
MW125.13 g/mol
LogP0.69
Rot. Bonds1

About 3-methylfuran-2-carboxamide

3-methylfuran-2-carboxamide (PubChem CID 10725345) has the molecular formula C6H7NO2 and a molecular weight of 125.13 g/mol. Its IUPAC name is 3-methylfuran-2-carboxamide.

Molecular Properties

Compound Name3-methylfuran-2-carboxamide
PubChem CID10725345
Molecular FormulaC6H7NO2
Molecular Weight125.13 g/mol
Exact Mass125.05
IUPAC Name3-methylfuran-2-carboxamide
SMILESCc1ccoc1C(N)=O
InChIInChI=1S/C6H7NO2/c1-4-2-3-9-5(4)6(7)8/h2-3H,1H3,(H2,7,8)
InChIKeyRDQSAEZUEUFCFX-UHFFFAOYSA-N
XLogP0.69
TPSA56.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500125.13
LogP ≤ 50.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-methylfuran-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-methylfuran-2-carboxamide?
The IUPAC name of 3-methylfuran-2-carboxamide (CID 10725345) is 3-methylfuran-2-carboxamide.
What is the SMILES notation for 3-methylfuran-2-carboxamide?
The canonical SMILES for 3-methylfuran-2-carboxamide is Cc1ccoc1C(N)=O.
What is the InChIKey of 3-methylfuran-2-carboxamide?
The InChIKey is RDQSAEZUEUFCFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7NO2/c1-4-2-3-9-5(4)6(7)8/h2-3H,1H3,(H2,7,8).
What are the key properties of 3-methylfuran-2-carboxamide?
3-methylfuran-2-carboxamide has a molecular weight of 125.13 g/mol, XLogP of 0.69, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methylfuran-2-carboxamide is sourced from PubChem (CID 10725345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).