4-chloro-6-(1-fluoropropan-2-yl)-1,3,5-triazin-2-amine

C6H8ClFN4 — CID 15430912

IUPAC4-chloro-6-(1-fluoropropan-2-yl)-1,3,5-triazin-2-amine
SMILESCC(CF)c1nc(N)nc(Cl)n1
InChIInChI=1S/C6H8ClFN4/c1-3(2-8)4-10-5(7)12-6(9)11-4/h3H,2H2,1H3,(H2,9,10,11,12)
InChIKeyPWCNJYFJBLZBIZ-UHFFFAOYSA-N
MW190.61 g/mol
LogP1.18
Rot. Bonds2

About 4-chloro-6-(1-fluoropropan-2-yl)-1,3,5-triazin-2-amine

4-chloro-6-(1-fluoropropan-2-yl)-1,3,5-triazin-2-amine (PubChem CID 15430912) has the molecular formula C6H8ClFN4 and a molecular weight of 190.61 g/mol. Its IUPAC name is 4-chloro-6-(1-fluoropropan-2-yl)-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-chloro-6-(1-fluoropropan-2-yl)-1,3,5-triazin-2-amine
PubChem CID15430912
Molecular FormulaC6H8ClFN4
Molecular Weight190.61 g/mol
Exact Mass190.04
IUPAC Name4-chloro-6-(1-fluoropropan-2-yl)-1,3,5-triazin-2-amine
SMILESCC(CF)c1nc(N)nc(Cl)n1
InChIInChI=1S/C6H8ClFN4/c1-3(2-8)4-10-5(7)12-6(9)11-4/h3H,2H2,1H3,(H2,9,10,11,12)
InChIKeyPWCNJYFJBLZBIZ-UHFFFAOYSA-N
XLogP1.18
TPSA64.69 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.61
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-chloro-6-(1-fluoropropan-2-yl)-1,3,5-triazin-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

Frequently Asked Questions

What is the IUPAC name of 4-chloro-6-(1-fluoropropan-2-yl)-1,3,5-triazin-2-amine?
The IUPAC name of 4-chloro-6-(1-fluoropropan-2-yl)-1,3,5-triazin-2-amine (CID 15430912) is 4-chloro-6-(1-fluoropropan-2-yl)-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-chloro-6-(1-fluoropropan-2-yl)-1,3,5-triazin-2-amine?
The canonical SMILES for 4-chloro-6-(1-fluoropropan-2-yl)-1,3,5-triazin-2-amine is CC(CF)c1nc(N)nc(Cl)n1.
What is the InChIKey of 4-chloro-6-(1-fluoropropan-2-yl)-1,3,5-triazin-2-amine?
The InChIKey is PWCNJYFJBLZBIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8ClFN4/c1-3(2-8)4-10-5(7)12-6(9)11-4/h3H,2H2,1H3,(H2,9,10,11,12).
What are the key properties of 4-chloro-6-(1-fluoropropan-2-yl)-1,3,5-triazin-2-amine?
4-chloro-6-(1-fluoropropan-2-yl)-1,3,5-triazin-2-amine has a molecular weight of 190.61 g/mol, XLogP of 1.18, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-6-(1-fluoropropan-2-yl)-1,3,5-triazin-2-amine is sourced from PubChem (CID 15430912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).