2-methyl-6-(4-methylpiperazin-1-yl)-N-propylpyrimidin-4-amine

C13H23N5 — CID 80766705

IUPAC2-methyl-6-(4-methylpiperazin-1-yl)-N-propylpyrimidin-4-amine
SMILESCCCNc1cc(N2CCN(C)CC2)nc(C)n1
InChIInChI=1S/C13H23N5/c1-4-5-14-12-10-13(16-11(2)15-12)18-8-6-17(3)7-9-18/h10H,4-9H2,1-3H3,(H,14,15,16)
InChIKeyZQCSGDDCGFQDCJ-UHFFFAOYSA-N
MW249.36 g/mol
LogP1.36
Rot. Bonds4

About 2-methyl-6-(4-methylpiperazin-1-yl)-N-propylpyrimidin-4-amine

2-methyl-6-(4-methylpiperazin-1-yl)-N-propylpyrimidin-4-amine (PubChem CID 80766705) has the molecular formula C13H23N5 and a molecular weight of 249.36 g/mol. Its IUPAC name is 2-methyl-6-(4-methylpiperazin-1-yl)-N-propylpyrimidin-4-amine.

Molecular Properties

Compound Name2-methyl-6-(4-methylpiperazin-1-yl)-N-propylpyrimidin-4-amine
PubChem CID80766705
Molecular FormulaC13H23N5
Molecular Weight249.36 g/mol
Exact Mass249.20
IUPAC Name2-methyl-6-(4-methylpiperazin-1-yl)-N-propylpyrimidin-4-amine
SMILESCCCNc1cc(N2CCN(C)CC2)nc(C)n1
InChIInChI=1S/C13H23N5/c1-4-5-14-12-10-13(16-11(2)15-12)18-8-6-17(3)7-9-18/h10H,4-9H2,1-3H3,(H,14,15,16)
InChIKeyZQCSGDDCGFQDCJ-UHFFFAOYSA-N
XLogP1.36
TPSA44.29 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.36
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-methyl-6-(4-methylpiperazin-1-yl)-N-propylpyrimidin-4-amine 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

2-methyl-N-propyl-6-thiomorpholin-4-ylpyrimidin-4-amine
CID 80765301
1-[4-[2-methyl-6-(propylamino)pyrimidin-4-yl]piperazin-1-yl]ethanone
CID 80767201
6-(4-methylpiperazin-1-yl)-N-propyl-2-(trifluoromethyl)pyrimidin-4-amine
CID 106770258
2-methyl-6-[4-(2-methylpropyl)piperazin-1-yl]-N-propylpyrimidin-4-amine
CID 80803337
2-methyl-6-[4-(3-methylphenyl)piperazin-1-yl]-N-propylpyrimidin-4-amine
CID 112867225
2-methyl-4-N-(4-methylpiperazin-1-yl)-6-N-propylpyrimidine-4,6-diamine
CID 83027220
6-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-methyl-N-propylpyrimidin-4-amine
CID 112867227
6-methyl-2-(4-methylpiperazin-1-yl)-N-propylpyrimidin-4-amine
CID 62191776
N-butyl-2-methyl-6-piperidin-1-ylpyrimidin-4-amine
CID 112867837
6-(4-methylpiperazin-1-yl)-N-propylpyridin-2-amine
CID 80766785
6-(3,4-dimethoxypyrrolidin-1-yl)-2-methyl-N-propylpyrimidin-4-amine
CID 103541915
6-(4-methylpiperazin-1-yl)-N-propyl-2-[(propylideneamino)methylsulfanyl]pyrimidin-4-amine
CID 138665591

Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-(4-methylpiperazin-1-yl)-N-propylpyrimidin-4-amine?
The IUPAC name of 2-methyl-6-(4-methylpiperazin-1-yl)-N-propylpyrimidin-4-amine (CID 80766705) is 2-methyl-6-(4-methylpiperazin-1-yl)-N-propylpyrimidin-4-amine.
What is the SMILES notation for 2-methyl-6-(4-methylpiperazin-1-yl)-N-propylpyrimidin-4-amine?
The canonical SMILES for 2-methyl-6-(4-methylpiperazin-1-yl)-N-propylpyrimidin-4-amine is CCCNc1cc(N2CCN(C)CC2)nc(C)n1.
What is the InChIKey of 2-methyl-6-(4-methylpiperazin-1-yl)-N-propylpyrimidin-4-amine?
The InChIKey is ZQCSGDDCGFQDCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N5/c1-4-5-14-12-10-13(16-11(2)15-12)18-8-6-17(3)7-9-18/h10H,4-9H2,1-3H3,(H,14,15,16).
What are the key properties of 2-methyl-6-(4-methylpiperazin-1-yl)-N-propylpyrimidin-4-amine?
2-methyl-6-(4-methylpiperazin-1-yl)-N-propylpyrimidin-4-amine has a molecular weight of 249.36 g/mol, XLogP of 1.36, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-(4-methylpiperazin-1-yl)-N-propylpyrimidin-4-amine is sourced from PubChem (CID 80766705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).