2,5-dimethyl-4-N-(4-methylpiperazin-1-yl)pyrimidine-4,6-diamine

C11H20N6 — CID 83027856

IUPAC2,5-dimethyl-4-N-(4-methylpiperazin-1-yl)pyrimidine-4,6-diamine
SMILESCc1nc(N)c(C)c(NN2CCN(C)CC2)n1
InChIInChI=1S/C11H20N6/c1-8-10(12)13-9(2)14-11(8)15-17-6-4-16(3)5-7-17/h4-7H2,1-3H3,(H3,12,13,14,15)
InChIKeyCFDDIDGPVAIGTJ-UHFFFAOYSA-N
MW236.32 g/mol
LogP0.25
Rot. Bonds2

About 2,5-dimethyl-4-N-(4-methylpiperazin-1-yl)pyrimidine-4,6-diamine

2,5-dimethyl-4-N-(4-methylpiperazin-1-yl)pyrimidine-4,6-diamine (PubChem CID 83027856) has the molecular formula C11H20N6 and a molecular weight of 236.32 g/mol. Its IUPAC name is 2,5-dimethyl-4-N-(4-methylpiperazin-1-yl)pyrimidine-4,6-diamine.

Molecular Properties

Compound Name2,5-dimethyl-4-N-(4-methylpiperazin-1-yl)pyrimidine-4,6-diamine
PubChem CID83027856
Molecular FormulaC11H20N6
Molecular Weight236.32 g/mol
Exact Mass236.17
IUPAC Name2,5-dimethyl-4-N-(4-methylpiperazin-1-yl)pyrimidine-4,6-diamine
SMILESCc1nc(N)c(C)c(NN2CCN(C)CC2)n1
InChIInChI=1S/C11H20N6/c1-8-10(12)13-9(2)14-11(8)15-17-6-4-16(3)5-7-17/h4-7H2,1-3H3,(H3,12,13,14,15)
InChIKeyCFDDIDGPVAIGTJ-UHFFFAOYSA-N
XLogP0.25
TPSA70.31 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.32
LogP ≤ 50.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 2,5-dimethyl-4-N-(4-methylpiperazin-1-yl)pyrimidine-4,6-diamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-[(2S)-2,4-dimethyl-1-piperazinyl]-5-fluoro-6-hydrazino-2-methylpyrimidine
CID 66935927
2-Ethyl-5-fluoro-4-hydrazino-6-(4-methyl-1-piperazinyl)pyrimidine
CID 66935975
4-[(2R)-2,4-dimethyl-1-piperazinyl]-5-fluoro-6-hydrazino-2-methylpyrimidine
CID 66936055
2-(Difluoromethyl)-5-fluoro-4-hydrazino-6-(4-methyl-1-piperazinyl)pyrimidine
CID 66936083
4-[(3R)-3,4-dimethyl-1-piperazinyl]-5-fluoro-6-hydrazino-2-methylpyrimidine
CID 66936099
4-[(3S)-3,4-dimethyl-1-piperazinyl]-5-fluoro-6-hydrazino-2-methylpyrimidine
CID 66936103
[6-(2,4-Dimethylpiperazin-1-yl)-5-fluoro-2-methylpyrimidin-4-yl]hydrazine
CID 77201064
[6-(3,4-Dimethylpiperazin-1-yl)-5-fluoro-2-methylpyrimidin-4-yl]hydrazine
CID 77201112
2-Chloro-5-fluoro-4-hydrazino-6-(4-methyl-1-piperazinyl)pyrimidine
CID 86636919
2-chloro-4-[(2R)-2,4-dimethyl-1-piperazinyl]-5-fluoro-6-hydrazinopyrimidine
CID 86636934
[2-Chloro-6-(2,4-dimethylpiperazin-1-yl)-5-fluoropyrimidin-4-yl]hydrazine
CID 90740815
[2-chloro-5-fluoro-6-[(2S,3R)-2,3,4-trimethylpiperazin-1-yl]pyrimidin-4-yl]hydrazine
CID 141303959

Frequently Asked Questions

What is the IUPAC name of 2,5-dimethyl-4-N-(4-methylpiperazin-1-yl)pyrimidine-4,6-diamine?
The IUPAC name of 2,5-dimethyl-4-N-(4-methylpiperazin-1-yl)pyrimidine-4,6-diamine (CID 83027856) is 2,5-dimethyl-4-N-(4-methylpiperazin-1-yl)pyrimidine-4,6-diamine.
What is the SMILES notation for 2,5-dimethyl-4-N-(4-methylpiperazin-1-yl)pyrimidine-4,6-diamine?
The canonical SMILES for 2,5-dimethyl-4-N-(4-methylpiperazin-1-yl)pyrimidine-4,6-diamine is Cc1nc(N)c(C)c(NN2CCN(C)CC2)n1.
What is the InChIKey of 2,5-dimethyl-4-N-(4-methylpiperazin-1-yl)pyrimidine-4,6-diamine?
The InChIKey is CFDDIDGPVAIGTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N6/c1-8-10(12)13-9(2)14-11(8)15-17-6-4-16(3)5-7-17/h4-7H2,1-3H3,(H3,12,13,14,15).
What are the key properties of 2,5-dimethyl-4-N-(4-methylpiperazin-1-yl)pyrimidine-4,6-diamine?
2,5-dimethyl-4-N-(4-methylpiperazin-1-yl)pyrimidine-4,6-diamine has a molecular weight of 236.32 g/mol, XLogP of 0.25, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethyl-4-N-(4-methylpiperazin-1-yl)pyrimidine-4,6-diamine is sourced from PubChem (CID 83027856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).