[4-(furan-2-yl)phenyl]methanamine

C11H11NO — CID 7537509

IUPAC[4-(furan-2-yl)phenyl]methanamine
SMILESNCc1ccc(-c2ccco2)cc1
InChIInChI=1S/C11H11NO/c12-8-9-3-5-10(6-4-9)11-2-1-7-13-11/h1-7H,8,12H2
InChIKeyTVKRLJUMZZXOHG-UHFFFAOYSA-N
MW173.21 g/mol
LogP2.41
Rot. Bonds2

About [4-(furan-2-yl)phenyl]methanamine

[4-(furan-2-yl)phenyl]methanamine (PubChem CID 7537509) has the molecular formula C11H11NO and a molecular weight of 173.21 g/mol. Its IUPAC name is [4-(furan-2-yl)phenyl]methanamine.

Molecular Properties

Compound Name[4-(furan-2-yl)phenyl]methanamine
PubChem CID7537509
Molecular FormulaC11H11NO
Molecular Weight173.21 g/mol
Exact Mass173.08
IUPAC Name[4-(furan-2-yl)phenyl]methanamine
SMILESNCc1ccc(-c2ccco2)cc1
InChIInChI=1S/C11H11NO/c12-8-9-3-5-10(6-4-9)11-2-1-7-13-11/h1-7H,8,12H2
InChIKeyTVKRLJUMZZXOHG-UHFFFAOYSA-N
XLogP2.41
TPSA39.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.21
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [4-(furan-2-yl)phenyl]methanamine?
The IUPAC name of [4-(furan-2-yl)phenyl]methanamine (CID 7537509) is [4-(furan-2-yl)phenyl]methanamine.
What is the SMILES notation for [4-(furan-2-yl)phenyl]methanamine?
The canonical SMILES for [4-(furan-2-yl)phenyl]methanamine is NCc1ccc(-c2ccco2)cc1.
What is the InChIKey of [4-(furan-2-yl)phenyl]methanamine?
The InChIKey is TVKRLJUMZZXOHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11NO/c12-8-9-3-5-10(6-4-9)11-2-1-7-13-11/h1-7H,8,12H2.
What are the key properties of [4-(furan-2-yl)phenyl]methanamine?
[4-(furan-2-yl)phenyl]methanamine has a molecular weight of 173.21 g/mol, XLogP of 2.41, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(furan-2-yl)phenyl]methanamine is sourced from PubChem (CID 7537509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).