5-methyl-2-N,4-N-bis(2-methylphenyl)pyrimidine-2,4-diamine

C19H20N4 — CID 22060421

IUPAC5-methyl-2-N,4-N-bis(2-methylphenyl)pyrimidine-2,4-diamine
SMILESCc1ccccc1Nc1ncc(C)c(Nc2ccccc2C)n1
InChIInChI=1S/C19H20N4/c1-13-8-4-6-10-16(13)21-18-15(3)12-20-19(23-18)22-17-11-7-5-9-14(17)2/h4-12H,1-3H3,(H2,20,21,22,23)
InChIKeyHOZCPTIVJAABKO-UHFFFAOYSA-N
MW304.40 g/mol
LogP4.89
Rot. Bonds4

About 5-methyl-2-N,4-N-bis(2-methylphenyl)pyrimidine-2,4-diamine

5-methyl-2-N,4-N-bis(2-methylphenyl)pyrimidine-2,4-diamine (PubChem CID 22060421) has the molecular formula C19H20N4 and a molecular weight of 304.40 g/mol. Its IUPAC name is 5-methyl-2-N,4-N-bis(2-methylphenyl)pyrimidine-2,4-diamine.

Molecular Properties

Compound Name5-methyl-2-N,4-N-bis(2-methylphenyl)pyrimidine-2,4-diamine
PubChem CID22060421
Molecular FormulaC19H20N4
Molecular Weight304.40 g/mol
Exact Mass304.17
IUPAC Name5-methyl-2-N,4-N-bis(2-methylphenyl)pyrimidine-2,4-diamine
SMILESCc1ccccc1Nc1ncc(C)c(Nc2ccccc2C)n1
InChIInChI=1S/C19H20N4/c1-13-8-4-6-10-16(13)21-18-15(3)12-20-19(23-18)22-17-11-7-5-9-14(17)2/h4-12H,1-3H3,(H2,20,21,22,23)
InChIKeyHOZCPTIVJAABKO-UHFFFAOYSA-N
XLogP4.89
TPSA49.84 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.40
LogP ≤ 54.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-N,4-N-bis(2-chlorophenyl)-5-methylpyrimidine-2,4-diamine
CID 5271601
5-methyl-2-N,4-N-bis(2-phenylphenyl)pyrimidine-2,4-diamine
CID 22060710
4-methyl-3-[[5-methyl-4-(2-methylanilino)pyrimidin-2-yl]amino]benzamide
CID 90337576
5-chloro-4-N-(2-methylphenyl)-2-N-phenylpyrimidine-2,4-diamine
CID 155665811
2-N-(3,4-dimethoxy-5-methylphenyl)-5-methyl-4-N-(2-methylphenyl)pyrimidine-2,4-diamine;ethane;molecular hydrogen;hydrate
CID 143878744
4-N-methyl-2-N-(2-methylphenyl)-5-nitropyrimidine-2,4-diamine
CID 21077398
carbanide;ethane;5-methyl-2-N,4-N-diphenylpyrimidine-2,4-diamine;yttrium
CID 157300828
2-N-ethyl-5-methyl-4-N-naphthalen-1-ylpyrimidine-2,4-diamine
CID 66792053
2-N-tert-butyl-4-N-(2,3-dimethylphenyl)-5-methylpyrimidine-2,4-diamine;ethane
CID 143939192
4-N-(2-chlorophenyl)-2-N-ethyl-5-methylpyrimidine-2,4-diamine
CID 80760295
5-bromo-2-N-ethyl-4-N-(2-methylphenyl)pyrimidine-2,4-diamine
CID 80754775
5-chloro-2-N-(2,4-dimethylphenyl)-4-N-(2-methylphenyl)pyrimidine-2,4-diamine;2-N-(2,4-dimethylphenyl)-5-methyl-4-N-(2-methylphenyl)pyrimidine-2,4-diamine;bis(2-N-(2,4-dimethylphenyl)-4-N-(2-methylphenyl)-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine);ethane
CID 159565488

Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-N,4-N-bis(2-methylphenyl)pyrimidine-2,4-diamine?
The IUPAC name of 5-methyl-2-N,4-N-bis(2-methylphenyl)pyrimidine-2,4-diamine (CID 22060421) is 5-methyl-2-N,4-N-bis(2-methylphenyl)pyrimidine-2,4-diamine.
What is the SMILES notation for 5-methyl-2-N,4-N-bis(2-methylphenyl)pyrimidine-2,4-diamine?
The canonical SMILES for 5-methyl-2-N,4-N-bis(2-methylphenyl)pyrimidine-2,4-diamine is Cc1ccccc1Nc1ncc(C)c(Nc2ccccc2C)n1.
What is the InChIKey of 5-methyl-2-N,4-N-bis(2-methylphenyl)pyrimidine-2,4-diamine?
The InChIKey is HOZCPTIVJAABKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4/c1-13-8-4-6-10-16(13)21-18-15(3)12-20-19(23-18)22-17-11-7-5-9-14(17)2/h4-12H,1-3H3,(H2,20,21,22,23).
What are the key properties of 5-methyl-2-N,4-N-bis(2-methylphenyl)pyrimidine-2,4-diamine?
5-methyl-2-N,4-N-bis(2-methylphenyl)pyrimidine-2,4-diamine has a molecular weight of 304.40 g/mol, XLogP of 4.89, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-N,4-N-bis(2-methylphenyl)pyrimidine-2,4-diamine is sourced from PubChem (CID 22060421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).