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

C13H23N5 — CID 62191776

IUPAC6-methyl-2-(4-methylpiperazin-1-yl)-N-propylpyrimidin-4-amine
SMILESCCCNc1cc(C)nc(N2CCN(C)CC2)n1
InChIInChI=1S/C13H23N5/c1-4-5-14-12-10-11(2)15-13(16-12)18-8-6-17(3)7-9-18/h10H,4-9H2,1-3H3,(H,14,15,16)
InChIKeyJXONYRMXEMAJGQ-UHFFFAOYSA-N
MW249.36 g/mol
LogP1.36
Rot. Bonds4

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

6-methyl-2-(4-methylpiperazin-1-yl)-N-propylpyrimidin-4-amine (PubChem CID 62191776) has the molecular formula C13H23N5 and a molecular weight of 249.36 g/mol. Its IUPAC name is 6-methyl-2-(4-methylpiperazin-1-yl)-N-propylpyrimidin-4-amine.

Molecular Properties

Compound Name6-methyl-2-(4-methylpiperazin-1-yl)-N-propylpyrimidin-4-amine
PubChem CID62191776
Molecular FormulaC13H23N5
Molecular Weight249.36 g/mol
Exact Mass249.20
IUPAC Name6-methyl-2-(4-methylpiperazin-1-yl)-N-propylpyrimidin-4-amine
SMILESCCCNc1cc(C)nc(N2CCN(C)CC2)n1
InChIInChI=1S/C13H23N5/c1-4-5-14-12-10-11(2)15-13(16-12)18-8-6-17(3)7-9-18/h10H,4-9H2,1-3H3,(H,14,15,16)
InChIKeyJXONYRMXEMAJGQ-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

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Related Compounds

2-(4-methylpiperazin-1-yl)-N,6-dipropylpyrimidin-4-amine
CID 62190377
2-(4-benzylpiperazin-1-yl)-6-methyl-N-propylpyrimidin-4-amine
CID 112906857
2-methyl-6-(4-methylpiperazin-1-yl)-N-propylpyrimidin-4-amine
CID 80766705
4-[2-[[6-methyl-2-(4-methylpiperazin-1-yl)pyrimidin-4-yl]amino]ethyl]benzenesulfonamide
CID 112913985
N-ethyl-6-methyl-2-piperidin-1-ylpyrimidin-4-amine
CID 62190895
N-butyl-2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-6-methylpyrimidin-4-amine
CID 112908138
2-methyl-4-N-(4-methylpiperazin-1-yl)-6-N-propylpyrimidine-4,6-diamine
CID 83027220
N-(2-methoxyethyl)-6-methyl-2-piperidin-1-ylpyrimidin-4-amine
CID 112910154
N-[[6-methyl-2-(4-methylpiperazin-1-yl)pyrimidin-4-yl]methyl]ethanamine
CID 55114763
N-ethyl-6-methyl-2-(4-methylsulfonylpiperazin-1-yl)pyrimidin-4-amine
CID 39730276
1-[4-[4-(ethylamino)-6-methylpyrimidin-2-yl]piperazin-1-yl]propan-1-one
CID 18566443
N-(3-bromo-4-methylphenyl)-6-methyl-2-(4-methylpiperazin-1-yl)pyrimidin-4-amine
CID 112914058

Frequently Asked Questions

What is the IUPAC name of 6-methyl-2-(4-methylpiperazin-1-yl)-N-propylpyrimidin-4-amine?
The IUPAC name of 6-methyl-2-(4-methylpiperazin-1-yl)-N-propylpyrimidin-4-amine (CID 62191776) is 6-methyl-2-(4-methylpiperazin-1-yl)-N-propylpyrimidin-4-amine.
What is the SMILES notation for 6-methyl-2-(4-methylpiperazin-1-yl)-N-propylpyrimidin-4-amine?
The canonical SMILES for 6-methyl-2-(4-methylpiperazin-1-yl)-N-propylpyrimidin-4-amine is CCCNc1cc(C)nc(N2CCN(C)CC2)n1.
What is the InChIKey of 6-methyl-2-(4-methylpiperazin-1-yl)-N-propylpyrimidin-4-amine?
The InChIKey is JXONYRMXEMAJGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N5/c1-4-5-14-12-10-11(2)15-13(16-12)18-8-6-17(3)7-9-18/h10H,4-9H2,1-3H3,(H,14,15,16).
What are the key properties of 6-methyl-2-(4-methylpiperazin-1-yl)-N-propylpyrimidin-4-amine?
6-methyl-2-(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 6-methyl-2-(4-methylpiperazin-1-yl)-N-propylpyrimidin-4-amine is sourced from PubChem (CID 62191776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).