furan-2-yl(phenyl)methanamine

C11H11NO — CID 3144389

IUPACfuran-2-yl(phenyl)methanamine
SMILESNC(c1ccccc1)c1ccco1
InChIInChI=1S/C11H11NO/c12-11(10-7-4-8-13-10)9-5-2-1-3-6-9/h1-8,11H,12H2
InChIKeyPUJSAEOHZQWRLE-UHFFFAOYSA-N
MW173.22 g/mol
LogP2.33
Rot. Bonds2

About furan-2-yl(phenyl)methanamine

furan-2-yl(phenyl)methanamine (PubChem CID 3144389) has the molecular formula C11H11NO and a molecular weight of 173.22 g/mol. Its IUPAC name is furan-2-yl(phenyl)methanamine.

Molecular Properties

Compound Namefuran-2-yl(phenyl)methanamine
PubChem CID3144389
Molecular FormulaC11H11NO
Molecular Weight173.22 g/mol
Exact Mass173.08
IUPAC Namefuran-2-yl(phenyl)methanamine
SMILESNC(c1ccccc1)c1ccco1
InChIInChI=1S/C11H11NO/c12-11(10-7-4-8-13-10)9-5-2-1-3-6-9/h1-8,11H,12H2
InChIKeyPUJSAEOHZQWRLE-UHFFFAOYSA-N
XLogP2.33
TPSA39.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.22
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of furan-2-yl(phenyl)methanamine?
The IUPAC name of furan-2-yl(phenyl)methanamine (CID 3144389) is furan-2-yl(phenyl)methanamine.
What is the SMILES notation for furan-2-yl(phenyl)methanamine?
The canonical SMILES for furan-2-yl(phenyl)methanamine is NC(c1ccccc1)c1ccco1.
What is the InChIKey of furan-2-yl(phenyl)methanamine?
The InChIKey is PUJSAEOHZQWRLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11NO/c12-11(10-7-4-8-13-10)9-5-2-1-3-6-9/h1-8,11H,12H2.
What are the key properties of furan-2-yl(phenyl)methanamine?
furan-2-yl(phenyl)methanamine has a molecular weight of 173.22 g/mol, XLogP of 2.33, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for furan-2-yl(phenyl)methanamine is sourced from PubChem (CID 3144389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).