6-(4-fluorophenyl)-N-[2-(4-fluorophenyl)-2-methylpropyl]pyridin-2-amine

C21H20F2N2 — CID 54591942

IUPAC6-(4-fluorophenyl)-N-[2-(4-fluorophenyl)-2-methylpropyl]pyridin-2-amine
SMILESCC(C)(CNc1cccc(-c2ccc(F)cc2)n1)c1ccc(F)cc1
InChIInChI=1S/C21H20F2N2/c1-21(2,16-8-12-18(23)13-9-16)14-24-20-5-3-4-19(25-20)15-6-10-17(22)11-7-15/h3-13H,14H2,1-2H3,(H,24,25)
InChIKeyNOBKNUTVEDQOSM-UHFFFAOYSA-N
MW338.40 g/mol
LogP5.42
Rot. Bonds5

About 6-(4-fluorophenyl)-N-[2-(4-fluorophenyl)-2-methylpropyl]pyridin-2-amine

6-(4-fluorophenyl)-N-[2-(4-fluorophenyl)-2-methylpropyl]pyridin-2-amine (PubChem CID 54591942) has the molecular formula C21H20F2N2 and a molecular weight of 338.40 g/mol. Its IUPAC name is 6-(4-fluorophenyl)-N-[2-(4-fluorophenyl)-2-methylpropyl]pyridin-2-amine.

Molecular Properties

Compound Name6-(4-fluorophenyl)-N-[2-(4-fluorophenyl)-2-methylpropyl]pyridin-2-amine
PubChem CID54591942
Molecular FormulaC21H20F2N2
Molecular Weight338.40 g/mol
Exact Mass338.16
IUPAC Name6-(4-fluorophenyl)-N-[2-(4-fluorophenyl)-2-methylpropyl]pyridin-2-amine
SMILESCC(C)(CNc1cccc(-c2ccc(F)cc2)n1)c1ccc(F)cc1
InChIInChI=1S/C21H20F2N2/c1-21(2,16-8-12-18(23)13-9-16)14-24-20-5-3-4-19(25-20)15-6-10-17(22)11-7-15/h3-13H,14H2,1-2H3,(H,24,25)
InChIKeyNOBKNUTVEDQOSM-UHFFFAOYSA-N
XLogP5.42
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500338.40
LogP ≤ 55.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-(4-fluorophenyl)-N-[2-(4-fluorophenyl)-2-methylpropyl]pyridin-2-amine?
The IUPAC name of 6-(4-fluorophenyl)-N-[2-(4-fluorophenyl)-2-methylpropyl]pyridin-2-amine (CID 54591942) is 6-(4-fluorophenyl)-N-[2-(4-fluorophenyl)-2-methylpropyl]pyridin-2-amine.
What is the SMILES notation for 6-(4-fluorophenyl)-N-[2-(4-fluorophenyl)-2-methylpropyl]pyridin-2-amine?
The canonical SMILES for 6-(4-fluorophenyl)-N-[2-(4-fluorophenyl)-2-methylpropyl]pyridin-2-amine is CC(C)(CNc1cccc(-c2ccc(F)cc2)n1)c1ccc(F)cc1.
What is the InChIKey of 6-(4-fluorophenyl)-N-[2-(4-fluorophenyl)-2-methylpropyl]pyridin-2-amine?
The InChIKey is NOBKNUTVEDQOSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20F2N2/c1-21(2,16-8-12-18(23)13-9-16)14-24-20-5-3-4-19(25-20)15-6-10-17(22)11-7-15/h3-13H,14H2,1-2H3,(H,24,25).
What are the key properties of 6-(4-fluorophenyl)-N-[2-(4-fluorophenyl)-2-methylpropyl]pyridin-2-amine?
6-(4-fluorophenyl)-N-[2-(4-fluorophenyl)-2-methylpropyl]pyridin-2-amine has a molecular weight of 338.40 g/mol, XLogP of 5.42, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-fluorophenyl)-N-[2-(4-fluorophenyl)-2-methylpropyl]pyridin-2-amine is sourced from PubChem (CID 54591942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).