4-(3,4-dimethylphenyl)-6-(4-methoxyphenyl)pyrimidin-2-amine

C19H19N3O — CID 75360175

IUPAC4-(3,4-dimethylphenyl)-6-(4-methoxyphenyl)pyrimidin-2-amine
SMILESCOc1ccc(-c2cc(-c3ccc(C)c(C)c3)nc(N)n2)cc1
InChIInChI=1S/C19H19N3O/c1-12-4-5-15(10-13(12)2)18-11-17(21-19(20)22-18)14-6-8-16(23-3)9-7-14/h4-11H,1-3H3,(H2,20,21,22)
InChIKeyBOBAVEFGEONVTJ-UHFFFAOYSA-N
MW305.38 g/mol
LogP4.02
Rot. Bonds3

About 4-(3,4-dimethylphenyl)-6-(4-methoxyphenyl)pyrimidin-2-amine

4-(3,4-dimethylphenyl)-6-(4-methoxyphenyl)pyrimidin-2-amine (PubChem CID 75360175) has the molecular formula C19H19N3O and a molecular weight of 305.38 g/mol. Its IUPAC name is 4-(3,4-dimethylphenyl)-6-(4-methoxyphenyl)pyrimidin-2-amine.

Molecular Properties

Compound Name4-(3,4-dimethylphenyl)-6-(4-methoxyphenyl)pyrimidin-2-amine
PubChem CID75360175
Molecular FormulaC19H19N3O
Molecular Weight305.38 g/mol
Exact Mass305.15
IUPAC Name4-(3,4-dimethylphenyl)-6-(4-methoxyphenyl)pyrimidin-2-amine
SMILESCOc1ccc(-c2cc(-c3ccc(C)c(C)c3)nc(N)n2)cc1
InChIInChI=1S/C19H19N3O/c1-12-4-5-15(10-13(12)2)18-11-17(21-19(20)22-18)14-6-8-16(23-3)9-7-14/h4-11H,1-3H3,(H2,20,21,22)
InChIKeyBOBAVEFGEONVTJ-UHFFFAOYSA-N
XLogP4.02
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.38
LogP ≤ 54.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(3,4-dimethylphenyl)-6-methylpyrimidin-2-amine
CID 62481951
4-(3-bromophenyl)-6-(4-methoxyphenyl)pyrimidin-2-amine
CID 75359610
4-N-tert-butyl-6-(4-methoxyphenyl)pyrimidine-2,4-diamine
CID 90189713
2,4,6-tris(4-methoxyphenyl)pyrimidine
CID 11784296
2,6-bis(4-methoxyphenyl)-4-methylpyridin-3-amine
CID 66615323
4-(2-chloro-6-fluorophenyl)-6-(4-methoxyphenyl)pyrimidin-2-amine
CID 75359612
4,6-bis(2,5-dimethoxyphenyl)pyrimidin-2-amine
CID 75359779
4-(2,4-dimethoxyphenyl)-6-(3-methylphenyl)pyrimidin-2-amine
CID 75359700
4-(1-benzofuran-2-yl)-6-(4-methoxyphenyl)pyrimidin-2-amine
CID 11381541
2-amino-6-(4-methoxyphenyl)-N-methylpyrimidine-4-carboxamide
CID 54854055
5-(3,4-dimethylphenyl)-3-methoxypyrazin-2-amine
CID 178183758
6-N-[4-[2-amino-6-(3-bromophenyl)pyrimidin-4-yl]phenyl]-2-N,4-N-bis(4-methoxyphenyl)-1,3,5-triazine-2,4,6-triamine
CID 71493670

Frequently Asked Questions

What is the IUPAC name of 4-(3,4-dimethylphenyl)-6-(4-methoxyphenyl)pyrimidin-2-amine?
The IUPAC name of 4-(3,4-dimethylphenyl)-6-(4-methoxyphenyl)pyrimidin-2-amine (CID 75360175) is 4-(3,4-dimethylphenyl)-6-(4-methoxyphenyl)pyrimidin-2-amine.
What is the SMILES notation for 4-(3,4-dimethylphenyl)-6-(4-methoxyphenyl)pyrimidin-2-amine?
The canonical SMILES for 4-(3,4-dimethylphenyl)-6-(4-methoxyphenyl)pyrimidin-2-amine is COc1ccc(-c2cc(-c3ccc(C)c(C)c3)nc(N)n2)cc1.
What is the InChIKey of 4-(3,4-dimethylphenyl)-6-(4-methoxyphenyl)pyrimidin-2-amine?
The InChIKey is BOBAVEFGEONVTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O/c1-12-4-5-15(10-13(12)2)18-11-17(21-19(20)22-18)14-6-8-16(23-3)9-7-14/h4-11H,1-3H3,(H2,20,21,22).
What are the key properties of 4-(3,4-dimethylphenyl)-6-(4-methoxyphenyl)pyrimidin-2-amine?
4-(3,4-dimethylphenyl)-6-(4-methoxyphenyl)pyrimidin-2-amine has a molecular weight of 305.38 g/mol, XLogP of 4.02, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3,4-dimethylphenyl)-6-(4-methoxyphenyl)pyrimidin-2-amine is sourced from PubChem (CID 75360175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).