3,6-bis(4-fluorophenyl)-N,N-dimethylpyridin-2-amine

C19H16F2N2 — CID 71658278

IUPAC3,6-bis(4-fluorophenyl)-N,N-dimethylpyridin-2-amine
SMILESCN(C)c1nc(-c2ccc(F)cc2)ccc1-c1ccc(F)cc1
InChIInChI=1S/C19H16F2N2/c1-23(2)19-17(13-3-7-15(20)8-4-13)11-12-18(22-19)14-5-9-16(21)10-6-14/h3-12H,1-2H3
InChIKeyNCHWMUYLXJYHMS-UHFFFAOYSA-N
MW310.35 g/mol
LogP4.76
Rot. Bonds3

About 3,6-bis(4-fluorophenyl)-N,N-dimethylpyridin-2-amine

3,6-bis(4-fluorophenyl)-N,N-dimethylpyridin-2-amine (PubChem CID 71658278) has the molecular formula C19H16F2N2 and a molecular weight of 310.35 g/mol. Its IUPAC name is 3,6-bis(4-fluorophenyl)-N,N-dimethylpyridin-2-amine.

Molecular Properties

Compound Name3,6-bis(4-fluorophenyl)-N,N-dimethylpyridin-2-amine
PubChem CID71658278
Molecular FormulaC19H16F2N2
Molecular Weight310.35 g/mol
Exact Mass310.13
IUPAC Name3,6-bis(4-fluorophenyl)-N,N-dimethylpyridin-2-amine
SMILESCN(C)c1nc(-c2ccc(F)cc2)ccc1-c1ccc(F)cc1
InChIInChI=1S/C19H16F2N2/c1-23(2)19-17(13-3-7-15(20)8-4-13)11-12-18(22-19)14-5-9-16(21)10-6-14/h3-12H,1-2H3
InChIKeyNCHWMUYLXJYHMS-UHFFFAOYSA-N
XLogP4.76
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.35
LogP ≤ 54.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3,6-bis(4-fluorophenyl)-N,N-dimethylpyridin-2-amine?
The IUPAC name of 3,6-bis(4-fluorophenyl)-N,N-dimethylpyridin-2-amine (CID 71658278) is 3,6-bis(4-fluorophenyl)-N,N-dimethylpyridin-2-amine.
What is the SMILES notation for 3,6-bis(4-fluorophenyl)-N,N-dimethylpyridin-2-amine?
The canonical SMILES for 3,6-bis(4-fluorophenyl)-N,N-dimethylpyridin-2-amine is CN(C)c1nc(-c2ccc(F)cc2)ccc1-c1ccc(F)cc1.
What is the InChIKey of 3,6-bis(4-fluorophenyl)-N,N-dimethylpyridin-2-amine?
The InChIKey is NCHWMUYLXJYHMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16F2N2/c1-23(2)19-17(13-3-7-15(20)8-4-13)11-12-18(22-19)14-5-9-16(21)10-6-14/h3-12H,1-2H3.
What are the key properties of 3,6-bis(4-fluorophenyl)-N,N-dimethylpyridin-2-amine?
3,6-bis(4-fluorophenyl)-N,N-dimethylpyridin-2-amine has a molecular weight of 310.35 g/mol, XLogP of 4.76, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,6-bis(4-fluorophenyl)-N,N-dimethylpyridin-2-amine is sourced from PubChem (CID 71658278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).