2-(furan-3-yl)ethanamine

C6H9NO — CID 15721844

IUPAC2-(furan-3-yl)ethanamine
SMILESNCCc1ccoc1
InChIInChI=1S/C6H9NO/c7-3-1-6-2-4-8-5-6/h2,4-5H,1,3,7H2
InChIKeyHQFMZQJGVKVYHK-UHFFFAOYSA-N
MW111.14 g/mol
LogP0.78
Rot. Bonds2

About 2-(furan-3-yl)ethanamine

2-(furan-3-yl)ethanamine (PubChem CID 15721844) has the molecular formula C6H9NO and a molecular weight of 111.14 g/mol. Its IUPAC name is 2-(furan-3-yl)ethanamine.

Molecular Properties

Compound Name2-(furan-3-yl)ethanamine
PubChem CID15721844
Molecular FormulaC6H9NO
Molecular Weight111.14 g/mol
Exact Mass111.07
IUPAC Name2-(furan-3-yl)ethanamine
SMILESNCCc1ccoc1
InChIInChI=1S/C6H9NO/c7-3-1-6-2-4-8-5-6/h2,4-5H,1,3,7H2
InChIKeyHQFMZQJGVKVYHK-UHFFFAOYSA-N
XLogP0.78
TPSA39.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500111.14
LogP ≤ 50.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(furan-3-yl)ethanamine?
The IUPAC name of 2-(furan-3-yl)ethanamine (CID 15721844) is 2-(furan-3-yl)ethanamine.
What is the SMILES notation for 2-(furan-3-yl)ethanamine?
The canonical SMILES for 2-(furan-3-yl)ethanamine is NCCc1ccoc1.
What is the InChIKey of 2-(furan-3-yl)ethanamine?
The InChIKey is HQFMZQJGVKVYHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9NO/c7-3-1-6-2-4-8-5-6/h2,4-5H,1,3,7H2.
What are the key properties of 2-(furan-3-yl)ethanamine?
2-(furan-3-yl)ethanamine has a molecular weight of 111.14 g/mol, XLogP of 0.78, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-3-yl)ethanamine is sourced from PubChem (CID 15721844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).