N,2-dimethyl-6-(2,2,2-trifluoroethoxy)pyrimidin-4-amine;hydrochloride

C8H11ClF3N3O — CID 175464510

IUPACN,2-dimethyl-6-(2,2,2-trifluoroethoxy)pyrimidin-4-amine;hydrochloride
SMILESCNc1cc(OCC(F)(F)F)nc(C)n1.Cl
InChIInChI=1S/C8H10F3N3O.ClH/c1-5-13-6(12-2)3-7(14-5)15-4-8(9,10)11;/h3H,4H2,1-2H3,(H,12,13,14);1H
InChIKeyASDZYHYQQXLAIW-UHFFFAOYSA-N
MW257.64 g/mol
LogP2.19
Rot. Bonds3

About N,2-dimethyl-6-(2,2,2-trifluoroethoxy)pyrimidin-4-amine;hydrochloride

N,2-dimethyl-6-(2,2,2-trifluoroethoxy)pyrimidin-4-amine;hydrochloride (PubChem CID 175464510) has the molecular formula C8H11ClF3N3O and a molecular weight of 257.64 g/mol. Its IUPAC name is N,2-dimethyl-6-(2,2,2-trifluoroethoxy)pyrimidin-4-amine;hydrochloride.

Molecular Properties

Compound NameN,2-dimethyl-6-(2,2,2-trifluoroethoxy)pyrimidin-4-amine;hydrochloride
PubChem CID175464510
Molecular FormulaC8H11ClF3N3O
Molecular Weight257.64 g/mol
Exact Mass257.05
IUPAC NameN,2-dimethyl-6-(2,2,2-trifluoroethoxy)pyrimidin-4-amine;hydrochloride
SMILESCNc1cc(OCC(F)(F)F)nc(C)n1.Cl
InChIInChI=1S/C8H10F3N3O.ClH/c1-5-13-6(12-2)3-7(14-5)15-4-8(9,10)11;/h3H,4H2,1-2H3,(H,12,13,14);1H
InChIKeyASDZYHYQQXLAIW-UHFFFAOYSA-N
XLogP2.19
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.64
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N,2-dimethyl-6-(2,2,2-trifluoroethoxy)pyrimidin-4-amine;hydrochloride 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

6-Methoxy-2-methylpyrimidin-4-amine
CID 549435
Pyrimidine, 2,4-diamino-6-(2-(dimethylamino)ethoxy)-
CID 202116
Pyrimidine, 2,4-diamino-6-(2-(diethylamino)ethoxy)-
CID 202117
4-N-butyl-6-methoxypyrimidine-2,4-diamine
CID 103817396
2-Amino-4,6-bis(2,2,2-trifluoroethoxy)pyrimidine
CID 4334263
6-(2-Methylpropoxy)pyrimidin-4-amine
CID 68058468
2,6-Di-(sec-butoxy)-4-aminopyrimidine
CID 478123
4-Isobutoxy-2,6-diisobutylamino-pyrimidine
CID 25129161
2-[2-[4-[2-(Dimethylamino)ethoxy]-6-(2-methoxyethylamino)pyrimidin-2-yl]oxyethyl]guanidine;hydrochloride
CID 44577031
2-[3-[4-[2-(Dimethylamino)ethoxy]-6-(2-methoxyethylamino)pyrimidin-2-yl]oxypropyl]guanidine;hydrochloride
CID 44577033
2-[3-[4-[2-(Dimethylamino)ethoxy]-6-(3-propan-2-yloxypropylamino)pyrimidin-2-yl]oxypropyl]guanidine;hydrochloride
CID 44577057
N-(2-methoxyethyl)-2,6-di(propan-2-yloxy)pyrimidin-4-amine
CID 44577415

Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-6-(2,2,2-trifluoroethoxy)pyrimidin-4-amine;hydrochloride?
The IUPAC name of N,2-dimethyl-6-(2,2,2-trifluoroethoxy)pyrimidin-4-amine;hydrochloride (CID 175464510) is N,2-dimethyl-6-(2,2,2-trifluoroethoxy)pyrimidin-4-amine;hydrochloride.
What is the SMILES notation for N,2-dimethyl-6-(2,2,2-trifluoroethoxy)pyrimidin-4-amine;hydrochloride?
The canonical SMILES for N,2-dimethyl-6-(2,2,2-trifluoroethoxy)pyrimidin-4-amine;hydrochloride is CNc1cc(OCC(F)(F)F)nc(C)n1.Cl.
What is the InChIKey of N,2-dimethyl-6-(2,2,2-trifluoroethoxy)pyrimidin-4-amine;hydrochloride?
The InChIKey is ASDZYHYQQXLAIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10F3N3O.ClH/c1-5-13-6(12-2)3-7(14-5)15-4-8(9,10)11;/h3H,4H2,1-2H3,(H,12,13,14);1H.
What are the key properties of N,2-dimethyl-6-(2,2,2-trifluoroethoxy)pyrimidin-4-amine;hydrochloride?
N,2-dimethyl-6-(2,2,2-trifluoroethoxy)pyrimidin-4-amine;hydrochloride has a molecular weight of 257.64 g/mol, XLogP of 2.19, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-6-(2,2,2-trifluoroethoxy)pyrimidin-4-amine;hydrochloride is sourced from PubChem (CID 175464510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).