4-chloro-N-(2,2-difluoropropyl)-N,6-dimethyl-1,3,5-triazin-2-amine

C8H11ClF2N4 — CID 164649428

IUPAC4-chloro-N-(2,2-difluoropropyl)-N,6-dimethyl-1,3,5-triazin-2-amine
SMILESCc1nc(Cl)nc(N(C)CC(C)(F)F)n1
InChIInChI=1S/C8H11ClF2N4/c1-5-12-6(9)14-7(13-5)15(3)4-8(2,10)11/h4H2,1-3H3
InChIKeyCDKBTAGBZXGHNH-UHFFFAOYSA-N
MW236.65 g/mol
LogP1.92
Rot. Bonds3

About 4-chloro-N-(2,2-difluoropropyl)-N,6-dimethyl-1,3,5-triazin-2-amine

4-chloro-N-(2,2-difluoropropyl)-N,6-dimethyl-1,3,5-triazin-2-amine (PubChem CID 164649428) has the molecular formula C8H11ClF2N4 and a molecular weight of 236.65 g/mol. Its IUPAC name is 4-chloro-N-(2,2-difluoropropyl)-N,6-dimethyl-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-chloro-N-(2,2-difluoropropyl)-N,6-dimethyl-1,3,5-triazin-2-amine
PubChem CID164649428
Molecular FormulaC8H11ClF2N4
Molecular Weight236.65 g/mol
Exact Mass236.06
IUPAC Name4-chloro-N-(2,2-difluoropropyl)-N,6-dimethyl-1,3,5-triazin-2-amine
SMILESCc1nc(Cl)nc(N(C)CC(C)(F)F)n1
InChIInChI=1S/C8H11ClF2N4/c1-5-12-6(9)14-7(13-5)15(3)4-8(2,10)11/h4H2,1-3H3
InChIKeyCDKBTAGBZXGHNH-UHFFFAOYSA-N
XLogP1.92
TPSA41.91 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.65
LogP ≤ 51.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 4-chloro-N-(2,2-difluoropropyl)-N,6-dimethyl-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

Related Compounds

4-chloro-N,N,6-trimethyl-1,3,5-triazin-2-amine
CID 18729118
4,6-bis[1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propan-2-yl]-N,N-dipropyl-1,3,5-triazin-2-amine
CID 541429
1,3,5-Triazine, 2-diethylamino-4,6-bis(nonafluoro-tert-butyl)-
CID 636025
3-[(4-Fluoro-6-methyl-1,3,5-triazin-2-yl)-methylamino]propanenitrile
CID 18729075
4-fluoro-N,N,6-trimethyl-1,3,5-triazin-2-amine
CID 54329421
2-Butyl-4-chloro-6-(3,3-difluoroazetidin-1-yl)-1,3,5-triazine
CID 138469122
4-chloro-6-methyl-N-(2,2,2-trifluoroethyl)-1,3,5-triazin-2-amine
CID 138469315
2-N,2-N-diethyl-6-(2,2,2-trifluoroethyl)-1,3,5-triazine-2,4-diamine
CID 139724197
2-N,2-N,4-N,4-N-tetramethyl-6-(3,3,3-trifluoropropyl)-1,3,5-triazine-2,4-diamine
CID 139724199
2-(3,3-Difluoropyrrolidin-1-yl)-4,6-dimethyl-1,3,5-triazine
CID 149525082
2-(3,3-Difluoropiperidin-1-yl)-4,6-dimethyl-1,3,5-triazine
CID 162575305
6-chloro-4-N,4-N-dimethyl-2-N-propyl-2-N-(2,2,2-trifluoroethyl)-1,3,5-triazine-2,4-diamine
CID 62863959

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-(2,2-difluoropropyl)-N,6-dimethyl-1,3,5-triazin-2-amine?
The IUPAC name of 4-chloro-N-(2,2-difluoropropyl)-N,6-dimethyl-1,3,5-triazin-2-amine (CID 164649428) is 4-chloro-N-(2,2-difluoropropyl)-N,6-dimethyl-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-chloro-N-(2,2-difluoropropyl)-N,6-dimethyl-1,3,5-triazin-2-amine?
The canonical SMILES for 4-chloro-N-(2,2-difluoropropyl)-N,6-dimethyl-1,3,5-triazin-2-amine is Cc1nc(Cl)nc(N(C)CC(C)(F)F)n1.
What is the InChIKey of 4-chloro-N-(2,2-difluoropropyl)-N,6-dimethyl-1,3,5-triazin-2-amine?
The InChIKey is CDKBTAGBZXGHNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11ClF2N4/c1-5-12-6(9)14-7(13-5)15(3)4-8(2,10)11/h4H2,1-3H3.
What are the key properties of 4-chloro-N-(2,2-difluoropropyl)-N,6-dimethyl-1,3,5-triazin-2-amine?
4-chloro-N-(2,2-difluoropropyl)-N,6-dimethyl-1,3,5-triazin-2-amine has a molecular weight of 236.65 g/mol, XLogP of 1.92, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-(2,2-difluoropropyl)-N,6-dimethyl-1,3,5-triazin-2-amine is sourced from PubChem (CID 164649428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).