4-N,4-N-diethyl-2-methyl-6-N-(2,4,6-trimethylphenyl)pyrimidine-4,6-diamine

C18H26N4 — CID 112875669

IUPAC4-N,4-N-diethyl-2-methyl-6-N-(2,4,6-trimethylphenyl)pyrimidine-4,6-diamine
SMILESCCN(CC)c1cc(Nc2c(C)cc(C)cc2C)nc(C)n1
InChIInChI=1S/C18H26N4/c1-7-22(8-2)17-11-16(19-15(6)20-17)21-18-13(4)9-12(3)10-14(18)5/h9-11H,7-8H2,1-6H3,(H,19,20,21)
InChIKeyZLIRDBWHNWHIHP-UHFFFAOYSA-N
MW298.43 g/mol
LogP4.30
Rot. Bonds5

About 4-N,4-N-diethyl-2-methyl-6-N-(2,4,6-trimethylphenyl)pyrimidine-4,6-diamine

4-N,4-N-diethyl-2-methyl-6-N-(2,4,6-trimethylphenyl)pyrimidine-4,6-diamine (PubChem CID 112875669) has the molecular formula C18H26N4 and a molecular weight of 298.43 g/mol. Its IUPAC name is 4-N,4-N-diethyl-2-methyl-6-N-(2,4,6-trimethylphenyl)pyrimidine-4,6-diamine.

Molecular Properties

Compound Name4-N,4-N-diethyl-2-methyl-6-N-(2,4,6-trimethylphenyl)pyrimidine-4,6-diamine
PubChem CID112875669
Molecular FormulaC18H26N4
Molecular Weight298.43 g/mol
Exact Mass298.22
IUPAC Name4-N,4-N-diethyl-2-methyl-6-N-(2,4,6-trimethylphenyl)pyrimidine-4,6-diamine
SMILESCCN(CC)c1cc(Nc2c(C)cc(C)cc2C)nc(C)n1
InChIInChI=1S/C18H26N4/c1-7-22(8-2)17-11-16(19-15(6)20-17)21-18-13(4)9-12(3)10-14(18)5/h9-11H,7-8H2,1-6H3,(H,19,20,21)
InChIKeyZLIRDBWHNWHIHP-UHFFFAOYSA-N
XLogP4.30
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.43
LogP ≤ 54.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-N-(2,4-dimethylphenyl)-4-N,4-N-diethyl-2-methylpyrimidine-4,6-diamine
CID 112875657
6-N-(2,6-diethylphenyl)-4-N,4-N-diethyl-2-methylpyrimidine-4,6-diamine
CID 112875670
6-N-(2-bromophenyl)-4-N,4-N-diethyl-2-methylpyrimidine-4,6-diamine
CID 112875723
4-N-tert-butyl-2-methyl-6-N-(2,4,6-trimethylphenyl)pyrimidine-4,6-diamine
CID 112875926
N-[4-[[6-(diethylamino)-2-methylpyrimidin-4-yl]amino]phenyl]-3,5-dimethylbenzamide
CID 122296625
4-N,4-N-diethyl-6-N-(2-methoxy-5-methylphenyl)-2-methylpyrimidine-4,6-diamine
CID 112875694
2-[[6-(diethylamino)-2-methylpyrimidin-4-yl]amino]benzonitrile
CID 112875748
1-[4-[[6-(diethylamino)-2-methylpyrimidin-4-yl]amino]phenyl]-3-phenylurea
CID 122296681
6-N-(3-chloro-4-methoxyphenyl)-4-N,4-N-diethyl-2-methylpyrimidine-4,6-diamine
CID 112875685
2-[ethyl-[2-methyl-6-(methylamino)pyrimidin-4-yl]amino]ethanol
CID 80791441
N-[6-(diethylamino)-2-methylpyrimidin-4-yl]benzamide
CID 65389183
N-[4-[[6-(diethylamino)-2-methylpyrimidin-4-yl]amino]phenyl]-4-fluorobenzamide
CID 122296595

Frequently Asked Questions

What is the IUPAC name of 4-N,4-N-diethyl-2-methyl-6-N-(2,4,6-trimethylphenyl)pyrimidine-4,6-diamine?
The IUPAC name of 4-N,4-N-diethyl-2-methyl-6-N-(2,4,6-trimethylphenyl)pyrimidine-4,6-diamine (CID 112875669) is 4-N,4-N-diethyl-2-methyl-6-N-(2,4,6-trimethylphenyl)pyrimidine-4,6-diamine.
What is the SMILES notation for 4-N,4-N-diethyl-2-methyl-6-N-(2,4,6-trimethylphenyl)pyrimidine-4,6-diamine?
The canonical SMILES for 4-N,4-N-diethyl-2-methyl-6-N-(2,4,6-trimethylphenyl)pyrimidine-4,6-diamine is CCN(CC)c1cc(Nc2c(C)cc(C)cc2C)nc(C)n1.
What is the InChIKey of 4-N,4-N-diethyl-2-methyl-6-N-(2,4,6-trimethylphenyl)pyrimidine-4,6-diamine?
The InChIKey is ZLIRDBWHNWHIHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N4/c1-7-22(8-2)17-11-16(19-15(6)20-17)21-18-13(4)9-12(3)10-14(18)5/h9-11H,7-8H2,1-6H3,(H,19,20,21).
What are the key properties of 4-N,4-N-diethyl-2-methyl-6-N-(2,4,6-trimethylphenyl)pyrimidine-4,6-diamine?
4-N,4-N-diethyl-2-methyl-6-N-(2,4,6-trimethylphenyl)pyrimidine-4,6-diamine has a molecular weight of 298.43 g/mol, XLogP of 4.30, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N,4-N-diethyl-2-methyl-6-N-(2,4,6-trimethylphenyl)pyrimidine-4,6-diamine is sourced from PubChem (CID 112875669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).