[2-(2,5-dihydrofuran-3-yl)phenyl]methanamine

C11H13NO — CID 105436151

IUPAC[2-(2,5-dihydrofuran-3-yl)phenyl]methanamine
SMILESNCc1ccccc1C1=CCOC1
InChIInChI=1S/C11H13NO/c12-7-9-3-1-2-4-11(9)10-5-6-13-8-10/h1-5H,6-8,12H2
InChIKeyAEJQCUTZKGSDPJ-UHFFFAOYSA-N
MW175.23 g/mol
LogP1.56
Rot. Bonds2

About [2-(2,5-dihydrofuran-3-yl)phenyl]methanamine

[2-(2,5-dihydrofuran-3-yl)phenyl]methanamine (PubChem CID 105436151) has the molecular formula C11H13NO and a molecular weight of 175.23 g/mol. Its IUPAC name is [2-(2,5-dihydrofuran-3-yl)phenyl]methanamine.

Molecular Properties

Compound Name[2-(2,5-dihydrofuran-3-yl)phenyl]methanamine
PubChem CID105436151
Molecular FormulaC11H13NO
Molecular Weight175.23 g/mol
Exact Mass175.10
IUPAC Name[2-(2,5-dihydrofuran-3-yl)phenyl]methanamine
SMILESNCc1ccccc1C1=CCOC1
InChIInChI=1S/C11H13NO/c12-7-9-3-1-2-4-11(9)10-5-6-13-8-10/h1-5H,6-8,12H2
InChIKeyAEJQCUTZKGSDPJ-UHFFFAOYSA-N
XLogP1.56
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.23
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [2-(2,5-dihydrofuran-3-yl)phenyl]methanamine?
The IUPAC name of [2-(2,5-dihydrofuran-3-yl)phenyl]methanamine (CID 105436151) is [2-(2,5-dihydrofuran-3-yl)phenyl]methanamine.
What is the SMILES notation for [2-(2,5-dihydrofuran-3-yl)phenyl]methanamine?
The canonical SMILES for [2-(2,5-dihydrofuran-3-yl)phenyl]methanamine is NCc1ccccc1C1=CCOC1.
What is the InChIKey of [2-(2,5-dihydrofuran-3-yl)phenyl]methanamine?
The InChIKey is AEJQCUTZKGSDPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13NO/c12-7-9-3-1-2-4-11(9)10-5-6-13-8-10/h1-5H,6-8,12H2.
What are the key properties of [2-(2,5-dihydrofuran-3-yl)phenyl]methanamine?
[2-(2,5-dihydrofuran-3-yl)phenyl]methanamine has a molecular weight of 175.23 g/mol, XLogP of 1.56, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2,5-dihydrofuran-3-yl)phenyl]methanamine is sourced from PubChem (CID 105436151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).