6-methoxy-N-(4-methylphenyl)-2-(3-methyl-2-pyridinyl)-5-(trifluoromethyl)pyrimidin-4-amine

C19H17F3N4O — CID 162358746

IUPAC6-methoxy-N-(4-methylphenyl)-2-(3-methyl-2-pyridinyl)-5-(trifluoromethyl)pyrimidin-4-amine
SMILESCOc1nc(-c2ncccc2C)nc(Nc2ccc(C)cc2)c1C(F)(F)F
InChIInChI=1S/C19H17F3N4O/c1-11-6-8-13(9-7-11)24-16-14(19(20,21)22)18(27-3)26-17(25-16)15-12(2)5-4-10-23-15/h4-10H,1-3H3,(H,24,25,26)
InChIKeyLNXHEXWLWAIMTA-UHFFFAOYSA-N
MW374.37 g/mol
LogP4.93
Rot. Bonds4

About 6-methoxy-N-(4-methylphenyl)-2-(3-methyl-2-pyridinyl)-5-(trifluoromethyl)pyrimidin-4-amine

6-methoxy-N-(4-methylphenyl)-2-(3-methyl-2-pyridinyl)-5-(trifluoromethyl)pyrimidin-4-amine (PubChem CID 162358746) has the molecular formula C19H17F3N4O and a molecular weight of 374.37 g/mol. Its IUPAC name is 6-methoxy-N-(4-methylphenyl)-2-(3-methyl-2-pyridinyl)-5-(trifluoromethyl)pyrimidin-4-amine.

Molecular Properties

Compound Name6-methoxy-N-(4-methylphenyl)-2-(3-methyl-2-pyridinyl)-5-(trifluoromethyl)pyrimidin-4-amine
PubChem CID162358746
Molecular FormulaC19H17F3N4O
Molecular Weight374.37 g/mol
Exact Mass374.14
IUPAC Name6-methoxy-N-(4-methylphenyl)-2-(3-methyl-2-pyridinyl)-5-(trifluoromethyl)pyrimidin-4-amine
SMILESCOc1nc(-c2ncccc2C)nc(Nc2ccc(C)cc2)c1C(F)(F)F
InChIInChI=1S/C19H17F3N4O/c1-11-6-8-13(9-7-11)24-16-14(19(20,21)22)18(27-3)26-17(25-16)15-12(2)5-4-10-23-15/h4-10H,1-3H3,(H,24,25,26)
InChIKeyLNXHEXWLWAIMTA-UHFFFAOYSA-N
XLogP4.93
TPSA59.93 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.37
LogP ≤ 54.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 6-methoxy-N-(4-methylphenyl)-2-(3-methyl-2-pyridinyl)-5-(trifluoromethyl)pyrimidin-4-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-((2-((2-Methoxy-5-methylpyridin-4-yl)amino)-5-(trifluoromethyl)pyrimidin-4-yl)amino)-5-methylphenyl)acrylamide
CID 90331177
4,6-Dimethoxy-N-[3-(trifluoromethyl)-2-pyridinyl]-2-pyrimidinamine
CID 138755794
N-[3-fluoro-4-[[[2-(methylamino)-6-pyridin-2-ylpyrimidin-4-yl]amino]methyl]phenyl]acetamide
CID 118716420
N-(2-phenylethyl)-2-pyridin-2-yl-6-(trifluoromethyl)pyrimidin-4-amine
CID 44590980
4-(3-Methoxyanilino)-2-(2-pyridinyl)-6-(trifluoromethyl)pyrimidine
CID 9950111
4-(5-Methoxy-2-methylanilino)-2-(4-pyridinyl)-6-(trifluoromethyl)pyrimidine
CID 10133127
4-(2-Methoxy-5-methylanilino)-2-(3-pyridinyl)-6-(trifluoromethyl)pyrimidine
CID 10133128
6-(pyridin-4-yl)-N-(4-(trifluoromethoxy)phenyl)pyrimidin-4-amine
CID 11381980
4-(2-Methoxy-5-methylanilino)-2-(4-pyridinyl)-6-(trifluoromethyl)pyrimidine
CID 22732426
4-(3-Methoxyanilino)-2-(3-pyridinyl)-6-(trifluoromethyl)pyrimidine
CID 22732443
2-methyl-N-(4-(trifluoromethyl)phenyl)-7-(3-(trifluoromethyl)pyridin-2-yl)-6,7,8,9-tetrahydro-5H-pyrimido[5,4-d]azepin-4-amine
CID 24783145
4-(4-Methoxy-3-pyridinyl)-6-(4-methylpiperazin-1-yl)pyrimidin-2-amine
CID 25129883

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-N-(4-methylphenyl)-2-(3-methyl-2-pyridinyl)-5-(trifluoromethyl)pyrimidin-4-amine?
The IUPAC name of 6-methoxy-N-(4-methylphenyl)-2-(3-methyl-2-pyridinyl)-5-(trifluoromethyl)pyrimidin-4-amine (CID 162358746) is 6-methoxy-N-(4-methylphenyl)-2-(3-methyl-2-pyridinyl)-5-(trifluoromethyl)pyrimidin-4-amine.
What is the SMILES notation for 6-methoxy-N-(4-methylphenyl)-2-(3-methyl-2-pyridinyl)-5-(trifluoromethyl)pyrimidin-4-amine?
The canonical SMILES for 6-methoxy-N-(4-methylphenyl)-2-(3-methyl-2-pyridinyl)-5-(trifluoromethyl)pyrimidin-4-amine is COc1nc(-c2ncccc2C)nc(Nc2ccc(C)cc2)c1C(F)(F)F.
What is the InChIKey of 6-methoxy-N-(4-methylphenyl)-2-(3-methyl-2-pyridinyl)-5-(trifluoromethyl)pyrimidin-4-amine?
The InChIKey is LNXHEXWLWAIMTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17F3N4O/c1-11-6-8-13(9-7-11)24-16-14(19(20,21)22)18(27-3)26-17(25-16)15-12(2)5-4-10-23-15/h4-10H,1-3H3,(H,24,25,26).
What are the key properties of 6-methoxy-N-(4-methylphenyl)-2-(3-methyl-2-pyridinyl)-5-(trifluoromethyl)pyrimidin-4-amine?
6-methoxy-N-(4-methylphenyl)-2-(3-methyl-2-pyridinyl)-5-(trifluoromethyl)pyrimidin-4-amine has a molecular weight of 374.37 g/mol, XLogP of 4.93, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-N-(4-methylphenyl)-2-(3-methyl-2-pyridinyl)-5-(trifluoromethyl)pyrimidin-4-amine is sourced from PubChem (CID 162358746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).