2-(5-methylfuran-2-yl)ethanamine

C7H11NO — CID 14933778

IUPAC2-(5-methylfuran-2-yl)ethanamine
SMILESCc1ccc(CCN)o1
InChIInChI=1S/C7H11NO/c1-6-2-3-7(9-6)4-5-8/h2-3H,4-5,8H2,1H3
InChIKeyKOFWQYALAZVVGL-UHFFFAOYSA-N
MW125.17 g/mol
LogP1.09
Rot. Bonds2

About 2-(5-methylfuran-2-yl)ethanamine

2-(5-methylfuran-2-yl)ethanamine (PubChem CID 14933778) has the molecular formula C7H11NO and a molecular weight of 125.17 g/mol. Its IUPAC name is 2-(5-methylfuran-2-yl)ethanamine.

Molecular Properties

Compound Name2-(5-methylfuran-2-yl)ethanamine
PubChem CID14933778
Molecular FormulaC7H11NO
Molecular Weight125.17 g/mol
Exact Mass125.08
IUPAC Name2-(5-methylfuran-2-yl)ethanamine
SMILESCc1ccc(CCN)o1
InChIInChI=1S/C7H11NO/c1-6-2-3-7(9-6)4-5-8/h2-3H,4-5,8H2,1H3
InChIKeyKOFWQYALAZVVGL-UHFFFAOYSA-N
XLogP1.09
TPSA39.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500125.17
LogP ≤ 51.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(5-methylfuran-2-yl)ethanamine?
The IUPAC name of 2-(5-methylfuran-2-yl)ethanamine (CID 14933778) is 2-(5-methylfuran-2-yl)ethanamine.
What is the SMILES notation for 2-(5-methylfuran-2-yl)ethanamine?
The canonical SMILES for 2-(5-methylfuran-2-yl)ethanamine is Cc1ccc(CCN)o1.
What is the InChIKey of 2-(5-methylfuran-2-yl)ethanamine?
The InChIKey is KOFWQYALAZVVGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11NO/c1-6-2-3-7(9-6)4-5-8/h2-3H,4-5,8H2,1H3.
What are the key properties of 2-(5-methylfuran-2-yl)ethanamine?
2-(5-methylfuran-2-yl)ethanamine has a molecular weight of 125.17 g/mol, XLogP of 1.09, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-methylfuran-2-yl)ethanamine is sourced from PubChem (CID 14933778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).