[5-(3-aminophenyl)furan-2-yl]methanol

C11H11NO2 — CID 1090743

IUPAC[5-(3-aminophenyl)furan-2-yl]methanol
SMILESNc1cccc(-c2ccc(CO)o2)c1
InChIInChI=1S/C11H11NO2/c12-9-3-1-2-8(6-9)11-5-4-10(7-13)14-11/h1-6,13H,7,12H2
InChIKeyXYPCPHVVJJTEMX-UHFFFAOYSA-N
MW189.21 g/mol
LogP2.02
Rot. Bonds2

About [5-(3-aminophenyl)furan-2-yl]methanol

[5-(3-aminophenyl)furan-2-yl]methanol (PubChem CID 1090743) has the molecular formula C11H11NO2 and a molecular weight of 189.21 g/mol. Its IUPAC name is [5-(3-aminophenyl)furan-2-yl]methanol.

Molecular Properties

Compound Name[5-(3-aminophenyl)furan-2-yl]methanol
PubChem CID1090743
Molecular FormulaC11H11NO2
Molecular Weight189.21 g/mol
Exact Mass189.08
IUPAC Name[5-(3-aminophenyl)furan-2-yl]methanol
SMILESNc1cccc(-c2ccc(CO)o2)c1
InChIInChI=1S/C11H11NO2/c12-9-3-1-2-8(6-9)11-5-4-10(7-13)14-11/h1-6,13H,7,12H2
InChIKeyXYPCPHVVJJTEMX-UHFFFAOYSA-N
XLogP2.02
TPSA59.39 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.21
LogP ≤ 52.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [5-(3-aminophenyl)furan-2-yl]methanol?
The IUPAC name of [5-(3-aminophenyl)furan-2-yl]methanol (CID 1090743) is [5-(3-aminophenyl)furan-2-yl]methanol.
What is the SMILES notation for [5-(3-aminophenyl)furan-2-yl]methanol?
The canonical SMILES for [5-(3-aminophenyl)furan-2-yl]methanol is Nc1cccc(-c2ccc(CO)o2)c1.
What is the InChIKey of [5-(3-aminophenyl)furan-2-yl]methanol?
The InChIKey is XYPCPHVVJJTEMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11NO2/c12-9-3-1-2-8(6-9)11-5-4-10(7-13)14-11/h1-6,13H,7,12H2.
What are the key properties of [5-(3-aminophenyl)furan-2-yl]methanol?
[5-(3-aminophenyl)furan-2-yl]methanol has a molecular weight of 189.21 g/mol, XLogP of 2.02, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(3-aminophenyl)furan-2-yl]methanol is sourced from PubChem (CID 1090743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).