(5-ethenylfuran-2-yl)methanamine

C7H9NO — CID 107430235

IUPAC(5-ethenylfuran-2-yl)methanamine
SMILESC=Cc1ccc(CN)o1
InChIInChI=1S/C7H9NO/c1-2-6-3-4-7(5-8)9-6/h2-4H,1,5,8H2
InChIKeyKBWCYGPQQHEYJK-UHFFFAOYSA-N
MW123.15 g/mol
LogP1.38
Rot. Bonds2

About (5-ethenylfuran-2-yl)methanamine

(5-ethenylfuran-2-yl)methanamine (PubChem CID 107430235) has the molecular formula C7H9NO and a molecular weight of 123.15 g/mol. Its IUPAC name is (5-ethenylfuran-2-yl)methanamine.

Molecular Properties

Compound Name(5-ethenylfuran-2-yl)methanamine
PubChem CID107430235
Molecular FormulaC7H9NO
Molecular Weight123.15 g/mol
Exact Mass123.07
IUPAC Name(5-ethenylfuran-2-yl)methanamine
SMILESC=Cc1ccc(CN)o1
InChIInChI=1S/C7H9NO/c1-2-6-3-4-7(5-8)9-6/h2-4H,1,5,8H2
InChIKeyKBWCYGPQQHEYJK-UHFFFAOYSA-N
XLogP1.38
TPSA39.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500123.15
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (5-ethenylfuran-2-yl)methanamine?
The IUPAC name of (5-ethenylfuran-2-yl)methanamine (CID 107430235) is (5-ethenylfuran-2-yl)methanamine.
What is the SMILES notation for (5-ethenylfuran-2-yl)methanamine?
The canonical SMILES for (5-ethenylfuran-2-yl)methanamine is C=Cc1ccc(CN)o1.
What is the InChIKey of (5-ethenylfuran-2-yl)methanamine?
The InChIKey is KBWCYGPQQHEYJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9NO/c1-2-6-3-4-7(5-8)9-6/h2-4H,1,5,8H2.
What are the key properties of (5-ethenylfuran-2-yl)methanamine?
(5-ethenylfuran-2-yl)methanamine has a molecular weight of 123.15 g/mol, XLogP of 1.38, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5-ethenylfuran-2-yl)methanamine is sourced from PubChem (CID 107430235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).