(5-phenylfuran-2-yl)methanamine

C11H11NO — CID 11993871

IUPAC(5-phenylfuran-2-yl)methanamine
SMILESNCc1ccc(-c2ccccc2)o1
InChIInChI=1S/C11H11NO/c12-8-10-6-7-11(13-10)9-4-2-1-3-5-9/h1-7H,8,12H2
InChIKeyHQHHWOJYOUTZHZ-UHFFFAOYSA-N
MW173.22 g/mol
LogP2.41
Rot. Bonds2

About (5-phenylfuran-2-yl)methanamine

(5-phenylfuran-2-yl)methanamine (PubChem CID 11993871) has the molecular formula C11H11NO and a molecular weight of 173.22 g/mol. Its IUPAC name is (5-phenylfuran-2-yl)methanamine.

Molecular Properties

Compound Name(5-phenylfuran-2-yl)methanamine
PubChem CID11993871
Molecular FormulaC11H11NO
Molecular Weight173.22 g/mol
Exact Mass173.08
IUPAC Name(5-phenylfuran-2-yl)methanamine
SMILESNCc1ccc(-c2ccccc2)o1
InChIInChI=1S/C11H11NO/c12-8-10-6-7-11(13-10)9-4-2-1-3-5-9/h1-7H,8,12H2
InChIKeyHQHHWOJYOUTZHZ-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 ≤ 500173.22
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (5-phenylfuran-2-yl)methanamine?
The IUPAC name of (5-phenylfuran-2-yl)methanamine (CID 11993871) is (5-phenylfuran-2-yl)methanamine.
What is the SMILES notation for (5-phenylfuran-2-yl)methanamine?
The canonical SMILES for (5-phenylfuran-2-yl)methanamine is NCc1ccc(-c2ccccc2)o1.
What is the InChIKey of (5-phenylfuran-2-yl)methanamine?
The InChIKey is HQHHWOJYOUTZHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11NO/c12-8-10-6-7-11(13-10)9-4-2-1-3-5-9/h1-7H,8,12H2.
What are the key properties of (5-phenylfuran-2-yl)methanamine?
(5-phenylfuran-2-yl)methanamine has a molecular weight of 173.22 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 (5-phenylfuran-2-yl)methanamine is sourced from PubChem (CID 11993871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).