4,6-dichloro-N-[2-(trifluoromethyl)-4-pyridinyl]pyrimidin-2-amine

C10H5Cl2F3N4 — CID 122677423

IUPAC4,6-dichloro-N-[2-(trifluoromethyl)-4-pyridinyl]pyrimidin-2-amine
SMILESFC(F)(F)c1cc(Nc2nc(Cl)cc(Cl)n2)ccn1
InChIInChI=1S/C10H5Cl2F3N4/c11-7-4-8(12)19-9(18-7)17-5-1-2-16-6(3-5)10(13,14)15/h1-4H,(H,16,17,18,19)
InChIKeyJFNYPSBOHFZVRX-UHFFFAOYSA-N
MW309.08 g/mol
LogP3.94
Rot. Bonds2

About 4,6-dichloro-N-[2-(trifluoromethyl)-4-pyridinyl]pyrimidin-2-amine

4,6-dichloro-N-[2-(trifluoromethyl)-4-pyridinyl]pyrimidin-2-amine (PubChem CID 122677423) has the molecular formula C10H5Cl2F3N4 and a molecular weight of 309.08 g/mol. Its IUPAC name is 4,6-dichloro-N-[2-(trifluoromethyl)-4-pyridinyl]pyrimidin-2-amine.

Molecular Properties

Compound Name4,6-dichloro-N-[2-(trifluoromethyl)-4-pyridinyl]pyrimidin-2-amine
PubChem CID122677423
Molecular FormulaC10H5Cl2F3N4
Molecular Weight309.08 g/mol
Exact Mass307.98
IUPAC Name4,6-dichloro-N-[2-(trifluoromethyl)-4-pyridinyl]pyrimidin-2-amine
SMILESFC(F)(F)c1cc(Nc2nc(Cl)cc(Cl)n2)ccn1
InChIInChI=1S/C10H5Cl2F3N4/c11-7-4-8(12)19-9(18-7)17-5-1-2-16-6(3-5)10(13,14)15/h1-4H,(H,16,17,18,19)
InChIKeyJFNYPSBOHFZVRX-UHFFFAOYSA-N
XLogP3.94
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.08
LogP ≤ 53.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4,6-dichloro-N-[2-(trifluoromethyl)-4-pyridinyl]pyrimidin-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[2-(trifluoromethyl)-4-pyridinyl]pyrimidin-2-amine
CID 10944517
4-chloro-6-(6-methyl-2-pyridinyl)-N-[2-(trifluoromethyl)-4-pyridinyl]-1,3,5-triazin-2-amine
CID 126550728
6-methyl-N-[2-(trifluoromethyl)-4-pyridinyl]pyridin-2-amine
CID 10682283
3-[[4-[[2-(trifluoromethyl)-4-pyridinyl]amino]-6-[4-(trifluoromethyl)pyrimidin-2-yl]-1,3,5-triazin-2-yl]amino]butan-2-ol
CID 175798156
4-N-propyl-2-N-[2-(trifluoromethyl)-4-pyridinyl]-6-[6-(trifluoromethyl)-2-pyridinyl]-1,3,5-triazine-2,4-diamine
CID 162592292
N-(2-phenoxyphenyl)-2-(trifluoromethyl)pyridin-4-amine
CID 3838394
4-chloro-6-(2,2,2-trifluoroethoxy)-N-[3-(trifluoromethyl)phenyl]pyrimidin-2-amine
CID 87442280
1-[[4-[6-(trifluoromethyl)-2-pyridinyl]-6-[[2-(trifluoromethyl)-4-pyridinyl]amino]-1,3,5-triazin-2-yl]amino]cyclopentan-1-ol
CID 175798155
(2S)-3-[[4-[[2-(trifluoromethyl)-4-pyridinyl]amino]-6-[[6-(trifluoromethyl)-2-pyridinyl]amino]-1,3,5-triazin-2-yl]amino]propane-1,2-diol
CID 159087837
4-(2,2,3,3,3-pentafluoropropoxy)-N-[2-(trifluoromethyl)-4-pyridinyl]-6-[6-(trifluoromethyl)-2-pyridinyl]-1,3,5-triazin-2-amine
CID 134197870
2-N-(1-methylcyclobutyl)-4-N-[2-(trifluoromethyl)-4-pyridinyl]-6-[6-(trifluoromethyl)-2-pyridinyl]-1,3,5-triazine-2,4-diamine
CID 161264106
methyl 4-chloro-2-[[2-(trifluoromethyl)-4-pyridinyl]amino]benzoate
CID 45141626

Frequently Asked Questions

What is the IUPAC name of 4,6-dichloro-N-[2-(trifluoromethyl)-4-pyridinyl]pyrimidin-2-amine?
The IUPAC name of 4,6-dichloro-N-[2-(trifluoromethyl)-4-pyridinyl]pyrimidin-2-amine (CID 122677423) is 4,6-dichloro-N-[2-(trifluoromethyl)-4-pyridinyl]pyrimidin-2-amine.
What is the SMILES notation for 4,6-dichloro-N-[2-(trifluoromethyl)-4-pyridinyl]pyrimidin-2-amine?
The canonical SMILES for 4,6-dichloro-N-[2-(trifluoromethyl)-4-pyridinyl]pyrimidin-2-amine is FC(F)(F)c1cc(Nc2nc(Cl)cc(Cl)n2)ccn1.
What is the InChIKey of 4,6-dichloro-N-[2-(trifluoromethyl)-4-pyridinyl]pyrimidin-2-amine?
The InChIKey is JFNYPSBOHFZVRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H5Cl2F3N4/c11-7-4-8(12)19-9(18-7)17-5-1-2-16-6(3-5)10(13,14)15/h1-4H,(H,16,17,18,19).
What are the key properties of 4,6-dichloro-N-[2-(trifluoromethyl)-4-pyridinyl]pyrimidin-2-amine?
4,6-dichloro-N-[2-(trifluoromethyl)-4-pyridinyl]pyrimidin-2-amine has a molecular weight of 309.08 g/mol, XLogP of 3.94, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-dichloro-N-[2-(trifluoromethyl)-4-pyridinyl]pyrimidin-2-amine is sourced from PubChem (CID 122677423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).