N-[3-phenyl-5-(trifluoromethyl)-1H-pyrazol-4-yl]pyridin-2-amine

C15H11F3N4 — CID 69156554

IUPACN-[3-phenyl-5-(trifluoromethyl)-1H-pyrazol-4-yl]pyridin-2-amine
SMILESFC(F)(F)c1[nH]nc(-c2ccccc2)c1Nc1ccccn1
InChIInChI=1S/C15H11F3N4/c16-15(17,18)14-13(20-11-8-4-5-9-19-11)12(21-22-14)10-6-2-1-3-7-10/h1-9H,(H,19,20)(H,21,22)
InChIKeyPHZMHYZEDXYOFU-UHFFFAOYSA-N
MW304.28 g/mol
LogP4.23
Rot. Bonds3

About N-[3-phenyl-5-(trifluoromethyl)-1H-pyrazol-4-yl]pyridin-2-amine

N-[3-phenyl-5-(trifluoromethyl)-1H-pyrazol-4-yl]pyridin-2-amine (PubChem CID 69156554) has the molecular formula C15H11F3N4 and a molecular weight of 304.28 g/mol. Its IUPAC name is N-[3-phenyl-5-(trifluoromethyl)-1H-pyrazol-4-yl]pyridin-2-amine.

Molecular Properties

Compound NameN-[3-phenyl-5-(trifluoromethyl)-1H-pyrazol-4-yl]pyridin-2-amine
PubChem CID69156554
Molecular FormulaC15H11F3N4
Molecular Weight304.28 g/mol
Exact Mass304.09
IUPAC NameN-[3-phenyl-5-(trifluoromethyl)-1H-pyrazol-4-yl]pyridin-2-amine
SMILESFC(F)(F)c1[nH]nc(-c2ccccc2)c1Nc1ccccn1
InChIInChI=1S/C15H11F3N4/c16-15(17,18)14-13(20-11-8-4-5-9-19-11)12(21-22-14)10-6-2-1-3-7-10/h1-9H,(H,19,20)(H,21,22)
InChIKeyPHZMHYZEDXYOFU-UHFFFAOYSA-N
XLogP4.23
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.28
LogP ≤ 54.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[3-phenyl-5-(trifluoromethyl)-1H-pyrazol-4-yl]pyridin-2-amine?
The IUPAC name of N-[3-phenyl-5-(trifluoromethyl)-1H-pyrazol-4-yl]pyridin-2-amine (CID 69156554) is N-[3-phenyl-5-(trifluoromethyl)-1H-pyrazol-4-yl]pyridin-2-amine.
What is the SMILES notation for N-[3-phenyl-5-(trifluoromethyl)-1H-pyrazol-4-yl]pyridin-2-amine?
The canonical SMILES for N-[3-phenyl-5-(trifluoromethyl)-1H-pyrazol-4-yl]pyridin-2-amine is FC(F)(F)c1[nH]nc(-c2ccccc2)c1Nc1ccccn1.
What is the InChIKey of N-[3-phenyl-5-(trifluoromethyl)-1H-pyrazol-4-yl]pyridin-2-amine?
The InChIKey is PHZMHYZEDXYOFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11F3N4/c16-15(17,18)14-13(20-11-8-4-5-9-19-11)12(21-22-14)10-6-2-1-3-7-10/h1-9H,(H,19,20)(H,21,22).
What are the key properties of N-[3-phenyl-5-(trifluoromethyl)-1H-pyrazol-4-yl]pyridin-2-amine?
N-[3-phenyl-5-(trifluoromethyl)-1H-pyrazol-4-yl]pyridin-2-amine has a molecular weight of 304.28 g/mol, XLogP of 4.23, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-phenyl-5-(trifluoromethyl)-1H-pyrazol-4-yl]pyridin-2-amine is sourced from PubChem (CID 69156554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).