N,N-diphenyl-5-(trifluoromethyl)pyridin-2-amine

C18H13F3N2 — CID 135001370

IUPACN,N-diphenyl-5-(trifluoromethyl)pyridin-2-amine
SMILESFC(F)(F)c1ccc(N(c2ccccc2)c2ccccc2)nc1
InChIInChI=1S/C18H13F3N2/c19-18(20,21)14-11-12-17(22-13-14)23(15-7-3-1-4-8-15)16-9-5-2-6-10-16/h1-13H
InChIKeyVWQMNOSJUYSZRE-UHFFFAOYSA-N
MW314.31 g/mol
LogP5.57
Rot. Bonds3

About N,N-diphenyl-5-(trifluoromethyl)pyridin-2-amine

N,N-diphenyl-5-(trifluoromethyl)pyridin-2-amine (PubChem CID 135001370) has the molecular formula C18H13F3N2 and a molecular weight of 314.31 g/mol. Its IUPAC name is N,N-diphenyl-5-(trifluoromethyl)pyridin-2-amine.

Molecular Properties

Compound NameN,N-diphenyl-5-(trifluoromethyl)pyridin-2-amine
PubChem CID135001370
Molecular FormulaC18H13F3N2
Molecular Weight314.31 g/mol
Exact Mass314.10
IUPAC NameN,N-diphenyl-5-(trifluoromethyl)pyridin-2-amine
SMILESFC(F)(F)c1ccc(N(c2ccccc2)c2ccccc2)nc1
InChIInChI=1S/C18H13F3N2/c19-18(20,21)14-11-12-17(22-13-14)23(15-7-3-1-4-8-15)16-9-5-2-6-10-16/h1-13H
InChIKeyVWQMNOSJUYSZRE-UHFFFAOYSA-N
XLogP5.57
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500314.31
LogP ≤ 55.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,N-diphenyl-5-(trifluoromethyl)pyridin-2-amine?
The IUPAC name of N,N-diphenyl-5-(trifluoromethyl)pyridin-2-amine (CID 135001370) is N,N-diphenyl-5-(trifluoromethyl)pyridin-2-amine.
What is the SMILES notation for N,N-diphenyl-5-(trifluoromethyl)pyridin-2-amine?
The canonical SMILES for N,N-diphenyl-5-(trifluoromethyl)pyridin-2-amine is FC(F)(F)c1ccc(N(c2ccccc2)c2ccccc2)nc1.
What is the InChIKey of N,N-diphenyl-5-(trifluoromethyl)pyridin-2-amine?
The InChIKey is VWQMNOSJUYSZRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13F3N2/c19-18(20,21)14-11-12-17(22-13-14)23(15-7-3-1-4-8-15)16-9-5-2-6-10-16/h1-13H.
What are the key properties of N,N-diphenyl-5-(trifluoromethyl)pyridin-2-amine?
N,N-diphenyl-5-(trifluoromethyl)pyridin-2-amine has a molecular weight of 314.31 g/mol, XLogP of 5.57, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diphenyl-5-(trifluoromethyl)pyridin-2-amine is sourced from PubChem (CID 135001370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).