1-[4-(3-aminophenyl)phenyl]-2H-pyridin-6-ol

C17H16N2O — CID 90104843

IUPAC1-[4-(3-aminophenyl)phenyl]-2H-pyridin-6-ol
SMILESNc1cccc(-c2ccc(N3CC=CC=C3O)cc2)c1
InChIInChI=1S/C17H16N2O/c18-15-5-3-4-14(12-15)13-7-9-16(10-8-13)19-11-2-1-6-17(19)20/h1-10,12,20H,11,18H2
InChIKeyIRHCPTKCHQUKLW-UHFFFAOYSA-N
MW264.33 g/mol
LogP3.71
Rot. Bonds2

About 1-[4-(3-aminophenyl)phenyl]-2H-pyridin-6-ol

1-[4-(3-aminophenyl)phenyl]-2H-pyridin-6-ol (PubChem CID 90104843) has the molecular formula C17H16N2O and a molecular weight of 264.33 g/mol. Its IUPAC name is 1-[4-(3-aminophenyl)phenyl]-2H-pyridin-6-ol.

Molecular Properties

Compound Name1-[4-(3-aminophenyl)phenyl]-2H-pyridin-6-ol
PubChem CID90104843
Molecular FormulaC17H16N2O
Molecular Weight264.33 g/mol
Exact Mass264.13
IUPAC Name1-[4-(3-aminophenyl)phenyl]-2H-pyridin-6-ol
SMILESNc1cccc(-c2ccc(N3CC=CC=C3O)cc2)c1
InChIInChI=1S/C17H16N2O/c18-15-5-3-4-14(12-15)13-7-9-16(10-8-13)19-11-2-1-6-17(19)20/h1-10,12,20H,11,18H2
InChIKeyIRHCPTKCHQUKLW-UHFFFAOYSA-N
XLogP3.71
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 53.71
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 1-[4-(3-aminophenyl)phenyl]-2H-pyridin-6-ol?
The IUPAC name of 1-[4-(3-aminophenyl)phenyl]-2H-pyridin-6-ol (CID 90104843) is 1-[4-(3-aminophenyl)phenyl]-2H-pyridin-6-ol.
What is the SMILES notation for 1-[4-(3-aminophenyl)phenyl]-2H-pyridin-6-ol?
The canonical SMILES for 1-[4-(3-aminophenyl)phenyl]-2H-pyridin-6-ol is Nc1cccc(-c2ccc(N3CC=CC=C3O)cc2)c1.
What is the InChIKey of 1-[4-(3-aminophenyl)phenyl]-2H-pyridin-6-ol?
The InChIKey is IRHCPTKCHQUKLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O/c18-15-5-3-4-14(12-15)13-7-9-16(10-8-13)19-11-2-1-6-17(19)20/h1-10,12,20H,11,18H2.
What are the key properties of 1-[4-(3-aminophenyl)phenyl]-2H-pyridin-6-ol?
1-[4-(3-aminophenyl)phenyl]-2H-pyridin-6-ol has a molecular weight of 264.33 g/mol, XLogP of 3.71, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(3-aminophenyl)phenyl]-2H-pyridin-6-ol is sourced from PubChem (CID 90104843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).