2-N,2-N-dimethyl-4-N,6-N-bis(4-methylphenyl)pyrimidine-2,4,6-triamine

C20H23N5 — CID 22398439

IUPAC2-N,2-N-dimethyl-4-N,6-N-bis(4-methylphenyl)pyrimidine-2,4,6-triamine
SMILESCc1ccc(Nc2cc(Nc3ccc(C)cc3)nc(N(C)C)n2)cc1
InChIInChI=1S/C20H23N5/c1-14-5-9-16(10-6-14)21-18-13-19(24-20(23-18)25(3)4)22-17-11-7-15(2)8-12-17/h5-13H,1-4H3,(H2,21,22,23,24)
InChIKeyOUCWGLGAMQBUMT-UHFFFAOYSA-N
MW333.44 g/mol
LogP4.65
Rot. Bonds5

About 2-N,2-N-dimethyl-4-N,6-N-bis(4-methylphenyl)pyrimidine-2,4,6-triamine

2-N,2-N-dimethyl-4-N,6-N-bis(4-methylphenyl)pyrimidine-2,4,6-triamine (PubChem CID 22398439) has the molecular formula C20H23N5 and a molecular weight of 333.44 g/mol. Its IUPAC name is 2-N,2-N-dimethyl-4-N,6-N-bis(4-methylphenyl)pyrimidine-2,4,6-triamine.

Molecular Properties

Compound Name2-N,2-N-dimethyl-4-N,6-N-bis(4-methylphenyl)pyrimidine-2,4,6-triamine
PubChem CID22398439
Molecular FormulaC20H23N5
Molecular Weight333.44 g/mol
Exact Mass333.20
IUPAC Name2-N,2-N-dimethyl-4-N,6-N-bis(4-methylphenyl)pyrimidine-2,4,6-triamine
SMILESCc1ccc(Nc2cc(Nc3ccc(C)cc3)nc(N(C)C)n2)cc1
InChIInChI=1S/C20H23N5/c1-14-5-9-16(10-6-14)21-18-13-19(24-20(23-18)25(3)4)22-17-11-7-15(2)8-12-17/h5-13H,1-4H3,(H2,21,22,23,24)
InChIKeyOUCWGLGAMQBUMT-UHFFFAOYSA-N
XLogP4.65
TPSA53.08 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.44
LogP ≤ 54.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-N,2-N-dimethyl-4-N,6-N-bis(4-methylphenyl)pyrimidine-2,4,6-triamine with MolForge

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Related Compounds

2-methyl-4-N-(4-methylphenyl)-6-N-phenylpyrimidine-4,6-diamine
CID 112876865
6-methyl-2-N,4-N-bis(4-methylphenyl)pyrimidine-2,4-diamine
CID 112927319
4-N-tert-butyl-2-methyl-6-N-(4-methylphenyl)pyrimidine-4,6-diamine
CID 112875910
3-N,6-N-bis(4-methylphenyl)pyridazine-3,6-diamine
CID 6411430
2-N-ethyl-6-methyl-4-N-(4-methylphenyl)-2-N-phenylpyrimidine-2,4-diamine
CID 112927331
2-N,2-N-diethyl-4-N-(4-methylphenyl)-6-phenylpyrimidine-2,4-diamine
CID 112937720
6-N-[4-(dimethylamino)phenyl]-2-methyl-4-N-propan-2-ylpyrimidine-4,6-diamine
CID 112867400
4-N-cyclohexyl-2-methyl-6-N-(4-methylphenyl)pyrimidine-4,6-diamine
CID 112869053
methyl 4-[[2-methyl-6-(4-methylanilino)pyrimidin-4-yl]amino]benzoate
CID 112877116
6-fluoro-N-(4-methylphenyl)-2-methylsulfanylpyrimidin-4-amine
CID 14461153
2-N,4-N-bis[4-(dimethylamino)phenyl]-6-methylpyrimidine-2,4-diamine
CID 112931685
5-methyl-N-(4-methylphenyl)-1,2-oxazol-3-amine
CID 122548872

Frequently Asked Questions

What is the IUPAC name of 2-N,2-N-dimethyl-4-N,6-N-bis(4-methylphenyl)pyrimidine-2,4,6-triamine?
The IUPAC name of 2-N,2-N-dimethyl-4-N,6-N-bis(4-methylphenyl)pyrimidine-2,4,6-triamine (CID 22398439) is 2-N,2-N-dimethyl-4-N,6-N-bis(4-methylphenyl)pyrimidine-2,4,6-triamine.
What is the SMILES notation for 2-N,2-N-dimethyl-4-N,6-N-bis(4-methylphenyl)pyrimidine-2,4,6-triamine?
The canonical SMILES for 2-N,2-N-dimethyl-4-N,6-N-bis(4-methylphenyl)pyrimidine-2,4,6-triamine is Cc1ccc(Nc2cc(Nc3ccc(C)cc3)nc(N(C)C)n2)cc1.
What is the InChIKey of 2-N,2-N-dimethyl-4-N,6-N-bis(4-methylphenyl)pyrimidine-2,4,6-triamine?
The InChIKey is OUCWGLGAMQBUMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N5/c1-14-5-9-16(10-6-14)21-18-13-19(24-20(23-18)25(3)4)22-17-11-7-15(2)8-12-17/h5-13H,1-4H3,(H2,21,22,23,24).
What are the key properties of 2-N,2-N-dimethyl-4-N,6-N-bis(4-methylphenyl)pyrimidine-2,4,6-triamine?
2-N,2-N-dimethyl-4-N,6-N-bis(4-methylphenyl)pyrimidine-2,4,6-triamine has a molecular weight of 333.44 g/mol, XLogP of 4.65, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,2-N-dimethyl-4-N,6-N-bis(4-methylphenyl)pyrimidine-2,4,6-triamine is sourced from PubChem (CID 22398439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).