3,4-dimethoxyfuran-2-amine

C6H9NO3 — CID 141306345

IUPAC3,4-dimethoxyfuran-2-amine
SMILESCOc1coc(N)c1OC
InChIInChI=1S/C6H9NO3/c1-8-4-3-10-6(7)5(4)9-2/h3H,7H2,1-2H3
InChIKeyOLKDRJFQOPDKGW-UHFFFAOYSA-N
MW143.14 g/mol
LogP0.88
Rot. Bonds2

About 3,4-dimethoxyfuran-2-amine

3,4-dimethoxyfuran-2-amine (PubChem CID 141306345) has the molecular formula C6H9NO3 and a molecular weight of 143.14 g/mol. Its IUPAC name is 3,4-dimethoxyfuran-2-amine.

Molecular Properties

Compound Name3,4-dimethoxyfuran-2-amine
PubChem CID141306345
Molecular FormulaC6H9NO3
Molecular Weight143.14 g/mol
Exact Mass143.06
IUPAC Name3,4-dimethoxyfuran-2-amine
SMILESCOc1coc(N)c1OC
InChIInChI=1S/C6H9NO3/c1-8-4-3-10-6(7)5(4)9-2/h3H,7H2,1-2H3
InChIKeyOLKDRJFQOPDKGW-UHFFFAOYSA-N
XLogP0.88
TPSA57.62 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.14
LogP ≤ 50.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3,4-dimethoxyfuran-2-amine?
The IUPAC name of 3,4-dimethoxyfuran-2-amine (CID 141306345) is 3,4-dimethoxyfuran-2-amine.
What is the SMILES notation for 3,4-dimethoxyfuran-2-amine?
The canonical SMILES for 3,4-dimethoxyfuran-2-amine is COc1coc(N)c1OC.
What is the InChIKey of 3,4-dimethoxyfuran-2-amine?
The InChIKey is OLKDRJFQOPDKGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9NO3/c1-8-4-3-10-6(7)5(4)9-2/h3H,7H2,1-2H3.
What are the key properties of 3,4-dimethoxyfuran-2-amine?
3,4-dimethoxyfuran-2-amine has a molecular weight of 143.14 g/mol, XLogP of 0.88, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dimethoxyfuran-2-amine is sourced from PubChem (CID 141306345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).