6-fluoro-N,N,3-triphenylpyridin-2-amine

C23H17FN2 — CID 175028516

IUPAC6-fluoro-N,N,3-triphenylpyridin-2-amine
SMILESFc1ccc(-c2ccccc2)c(N(c2ccccc2)c2ccccc2)n1
InChIInChI=1S/C23H17FN2/c24-22-17-16-21(18-10-4-1-5-11-18)23(25-22)26(19-12-6-2-7-13-19)20-14-8-3-9-15-20/h1-17H
InChIKeyDVDVHXVKSLHTQT-UHFFFAOYSA-N
MW340.40 g/mol
LogP6.36
Rot. Bonds4

About 6-fluoro-N,N,3-triphenylpyridin-2-amine

6-fluoro-N,N,3-triphenylpyridin-2-amine (PubChem CID 175028516) has the molecular formula C23H17FN2 and a molecular weight of 340.40 g/mol. Its IUPAC name is 6-fluoro-N,N,3-triphenylpyridin-2-amine.

Molecular Properties

Compound Name6-fluoro-N,N,3-triphenylpyridin-2-amine
PubChem CID175028516
Molecular FormulaC23H17FN2
Molecular Weight340.40 g/mol
Exact Mass340.14
IUPAC Name6-fluoro-N,N,3-triphenylpyridin-2-amine
SMILESFc1ccc(-c2ccccc2)c(N(c2ccccc2)c2ccccc2)n1
InChIInChI=1S/C23H17FN2/c24-22-17-16-21(18-10-4-1-5-11-18)23(25-22)26(19-12-6-2-7-13-19)20-14-8-3-9-15-20/h1-17H
InChIKeyDVDVHXVKSLHTQT-UHFFFAOYSA-N
XLogP6.36
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500340.40
LogP ≤ 56.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 6-fluoro-N,N,3-triphenylpyridin-2-amine?
The IUPAC name of 6-fluoro-N,N,3-triphenylpyridin-2-amine (CID 175028516) is 6-fluoro-N,N,3-triphenylpyridin-2-amine.
What is the SMILES notation for 6-fluoro-N,N,3-triphenylpyridin-2-amine?
The canonical SMILES for 6-fluoro-N,N,3-triphenylpyridin-2-amine is Fc1ccc(-c2ccccc2)c(N(c2ccccc2)c2ccccc2)n1.
What is the InChIKey of 6-fluoro-N,N,3-triphenylpyridin-2-amine?
The InChIKey is DVDVHXVKSLHTQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H17FN2/c24-22-17-16-21(18-10-4-1-5-11-18)23(25-22)26(19-12-6-2-7-13-19)20-14-8-3-9-15-20/h1-17H.
What are the key properties of 6-fluoro-N,N,3-triphenylpyridin-2-amine?
6-fluoro-N,N,3-triphenylpyridin-2-amine has a molecular weight of 340.40 g/mol, XLogP of 6.36, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-N,N,3-triphenylpyridin-2-amine is sourced from PubChem (CID 175028516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).