furan-2-carboxylic acid;methanamine

C6H9NO3 — CID 82372767

IUPACfuran-2-carboxylic acid;methanamine
SMILESCN.O=C(O)c1ccco1
InChIInChI=1S/C5H4O3.CH5N/c6-5(7)4-2-1-3-8-4;1-2/h1-3H,(H,6,7);2H2,1H3
InChIKeyIILWMUKQIRIZAM-UHFFFAOYSA-N
MW143.14 g/mol
LogP0.55
Rot. Bonds1

About furan-2-carboxylic acid;methanamine

furan-2-carboxylic acid;methanamine (PubChem CID 82372767) has the molecular formula C6H9NO3 and a molecular weight of 143.14 g/mol. Its IUPAC name is furan-2-carboxylic acid;methanamine.

Molecular Properties

Compound Namefuran-2-carboxylic acid;methanamine
PubChem CID82372767
Molecular FormulaC6H9NO3
Molecular Weight143.14 g/mol
Exact Mass143.06
IUPAC Namefuran-2-carboxylic acid;methanamine
SMILESCN.O=C(O)c1ccco1
InChIInChI=1S/C5H4O3.CH5N/c6-5(7)4-2-1-3-8-4;1-2/h1-3H,(H,6,7);2H2,1H3
InChIKeyIILWMUKQIRIZAM-UHFFFAOYSA-N
XLogP0.55
TPSA76.46 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.14
LogP ≤ 50.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of furan-2-carboxylic acid;methanamine?
The IUPAC name of furan-2-carboxylic acid;methanamine (CID 82372767) is furan-2-carboxylic acid;methanamine.
What is the SMILES notation for furan-2-carboxylic acid;methanamine?
The canonical SMILES for furan-2-carboxylic acid;methanamine is CN.O=C(O)c1ccco1.
What is the InChIKey of furan-2-carboxylic acid;methanamine?
The InChIKey is IILWMUKQIRIZAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H4O3.CH5N/c6-5(7)4-2-1-3-8-4;1-2/h1-3H,(H,6,7);2H2,1H3.
What are the key properties of furan-2-carboxylic acid;methanamine?
furan-2-carboxylic acid;methanamine has a molecular weight of 143.14 g/mol, XLogP of 0.55, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for furan-2-carboxylic acid;methanamine is sourced from PubChem (CID 82372767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).