4-N,6-N-dimethyl-4-N-(2,4,5-trimethylphenyl)pyrimidine-4,6-diamine

C15H20N4 — CID 115265462

IUPAC4-N,6-N-dimethyl-4-N-(2,4,5-trimethylphenyl)pyrimidine-4,6-diamine
SMILESCNc1cc(N(C)c2cc(C)c(C)cc2C)ncn1
InChIInChI=1S/C15H20N4/c1-10-6-12(3)13(7-11(10)2)19(5)15-8-14(16-4)17-9-18-15/h6-9H,1-5H3,(H,16,17,18)
InChIKeyYHJKBGFVMIJHAL-UHFFFAOYSA-N
MW256.35 g/mol
LogP3.21
Rot. Bonds3

About 4-N,6-N-dimethyl-4-N-(2,4,5-trimethylphenyl)pyrimidine-4,6-diamine

4-N,6-N-dimethyl-4-N-(2,4,5-trimethylphenyl)pyrimidine-4,6-diamine (PubChem CID 115265462) has the molecular formula C15H20N4 and a molecular weight of 256.35 g/mol. Its IUPAC name is 4-N,6-N-dimethyl-4-N-(2,4,5-trimethylphenyl)pyrimidine-4,6-diamine.

Molecular Properties

Compound Name4-N,6-N-dimethyl-4-N-(2,4,5-trimethylphenyl)pyrimidine-4,6-diamine
PubChem CID115265462
Molecular FormulaC15H20N4
Molecular Weight256.35 g/mol
Exact Mass256.17
IUPAC Name4-N,6-N-dimethyl-4-N-(2,4,5-trimethylphenyl)pyrimidine-4,6-diamine
SMILESCNc1cc(N(C)c2cc(C)c(C)cc2C)ncn1
InChIInChI=1S/C15H20N4/c1-10-6-12(3)13(7-11(10)2)19(5)15-8-14(16-4)17-9-18-15/h6-9H,1-5H3,(H,16,17,18)
InChIKeyYHJKBGFVMIJHAL-UHFFFAOYSA-N
XLogP3.21
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-N-(2-methoxy-5-methylphenyl)-4-N,6-N-dimethylpyrimidine-4,6-diamine
CID 115265440
4-N-(4-methoxy-3-methylphenyl)-4-N,6-N-dimethylpyrimidine-4,6-diamine
CID 115265439
4-N,6-N-dimethyl-4-N-(3-methylthiophen-2-yl)pyrimidine-4,6-diamine
CID 115265487
4-N,6-N-dimethyl-4-N-pyridin-4-ylpyrimidine-4,6-diamine
CID 115265479
4-N-[(2,4-dimethylphenyl)methyl]-4-N,6-N-dimethylpyrimidine-4,6-diamine
CID 115265529
4-N-(5-chlorothiophen-2-yl)-4-N,6-N-dimethylpyrimidine-4,6-diamine
CID 115265446
4-N-(5-bromothiophen-2-yl)-4-N,6-N-dimethylpyrimidine-4,6-diamine
CID 115265447
[6-(5-bromo-N,2-dimethylanilino)pyrimidin-4-yl]cyanamide
CID 115264585
4-N,4-N-diethyl-6-N-methylpyrimidine-4,6-diamine
CID 80767008
4-N-cyclopropyl-4-N,6-N-dimethylpyrimidine-4,6-diamine
CID 80775441
4-N,6-N-dimethyl-4-N-[2-(2-methylphenyl)ethyl]pyrimidine-4,6-diamine
CID 115265586
4-N-methyl-4-N-(2-methylphenyl)-6-N-propan-2-ylpyrimidine-4,6-diamine
CID 115265781

Frequently Asked Questions

What is the IUPAC name of 4-N,6-N-dimethyl-4-N-(2,4,5-trimethylphenyl)pyrimidine-4,6-diamine?
The IUPAC name of 4-N,6-N-dimethyl-4-N-(2,4,5-trimethylphenyl)pyrimidine-4,6-diamine (CID 115265462) is 4-N,6-N-dimethyl-4-N-(2,4,5-trimethylphenyl)pyrimidine-4,6-diamine.
What is the SMILES notation for 4-N,6-N-dimethyl-4-N-(2,4,5-trimethylphenyl)pyrimidine-4,6-diamine?
The canonical SMILES for 4-N,6-N-dimethyl-4-N-(2,4,5-trimethylphenyl)pyrimidine-4,6-diamine is CNc1cc(N(C)c2cc(C)c(C)cc2C)ncn1.
What is the InChIKey of 4-N,6-N-dimethyl-4-N-(2,4,5-trimethylphenyl)pyrimidine-4,6-diamine?
The InChIKey is YHJKBGFVMIJHAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4/c1-10-6-12(3)13(7-11(10)2)19(5)15-8-14(16-4)17-9-18-15/h6-9H,1-5H3,(H,16,17,18).
What are the key properties of 4-N,6-N-dimethyl-4-N-(2,4,5-trimethylphenyl)pyrimidine-4,6-diamine?
4-N,6-N-dimethyl-4-N-(2,4,5-trimethylphenyl)pyrimidine-4,6-diamine has a molecular weight of 256.35 g/mol, XLogP of 3.21, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N,6-N-dimethyl-4-N-(2,4,5-trimethylphenyl)pyrimidine-4,6-diamine is sourced from PubChem (CID 115265462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).