2-(furan-2-yl)ethanamine

C6H9NO — CID 1132863

IUPAC2-(furan-2-yl)ethanamine
SMILESNCCc1ccco1
InChIInChI=1S/C6H9NO/c7-4-3-6-2-1-5-8-6/h1-2,5H,3-4,7H2
InChIKeyZQSLNSHMUQXSQJ-UHFFFAOYSA-N
MW111.14 g/mol
LogP0.78
Rot. Bonds2

About 2-(furan-2-yl)ethanamine

2-(furan-2-yl)ethanamine (PubChem CID 1132863) has the molecular formula C6H9NO and a molecular weight of 111.14 g/mol. Its IUPAC name is 2-(furan-2-yl)ethanamine.

Molecular Properties

Compound Name2-(furan-2-yl)ethanamine
PubChem CID1132863
Molecular FormulaC6H9NO
Molecular Weight111.14 g/mol
Exact Mass111.07
IUPAC Name2-(furan-2-yl)ethanamine
SMILESNCCc1ccco1
InChIInChI=1S/C6H9NO/c7-4-3-6-2-1-5-8-6/h1-2,5H,3-4,7H2
InChIKeyZQSLNSHMUQXSQJ-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-2-yl)ethanamine?
The IUPAC name of 2-(furan-2-yl)ethanamine (CID 1132863) is 2-(furan-2-yl)ethanamine.
What is the SMILES notation for 2-(furan-2-yl)ethanamine?
The canonical SMILES for 2-(furan-2-yl)ethanamine is NCCc1ccco1.
What is the InChIKey of 2-(furan-2-yl)ethanamine?
The InChIKey is ZQSLNSHMUQXSQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9NO/c7-4-3-6-2-1-5-8-6/h1-2,5H,3-4,7H2.
What are the key properties of 2-(furan-2-yl)ethanamine?
2-(furan-2-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-2-yl)ethanamine is sourced from PubChem (CID 1132863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).