2-[4-(6-methylpyrimidin-4-yl)piperazin-1-yl]ethanamine

C11H19N5 — CID 61225493

IUPAC2-[4-(6-methylpyrimidin-4-yl)piperazin-1-yl]ethanamine
SMILESCc1cc(N2CCN(CCN)CC2)ncn1
InChIInChI=1S/C11H19N5/c1-10-8-11(14-9-13-10)16-6-4-15(3-2-12)5-7-16/h8-9H,2-7,12H2,1H3
InChIKeySLPXCQZQBMADCK-UHFFFAOYSA-N
MW221.31 g/mol
LogP-0.13
Rot. Bonds3

About 2-[4-(6-methylpyrimidin-4-yl)piperazin-1-yl]ethanamine

2-[4-(6-methylpyrimidin-4-yl)piperazin-1-yl]ethanamine (PubChem CID 61225493) has the molecular formula C11H19N5 and a molecular weight of 221.31 g/mol. Its IUPAC name is 2-[4-(6-methylpyrimidin-4-yl)piperazin-1-yl]ethanamine.

Molecular Properties

Compound Name2-[4-(6-methylpyrimidin-4-yl)piperazin-1-yl]ethanamine
PubChem CID61225493
Molecular FormulaC11H19N5
Molecular Weight221.31 g/mol
Exact Mass221.16
IUPAC Name2-[4-(6-methylpyrimidin-4-yl)piperazin-1-yl]ethanamine
SMILESCc1cc(N2CCN(CCN)CC2)ncn1
InChIInChI=1S/C11H19N5/c1-10-8-11(14-9-13-10)16-6-4-15(3-2-12)5-7-16/h8-9H,2-7,12H2,1H3
InChIKeySLPXCQZQBMADCK-UHFFFAOYSA-N
XLogP-0.13
TPSA58.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.31
LogP ≤ 5-0.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-[4-(6-methylpyrimidin-4-yl)piperazin-1-yl]propan-1-amine
CID 61225491
3-[4-(6-methylpyrimidin-4-yl)-1,4-diazepan-1-yl]propan-1-amine
CID 61225492
2-[4-(6-ethoxypyrimidin-4-yl)-1,4-diazepan-1-yl]ethanamine
CID 66318119
2-[4-(6-phenylpyrimidin-4-yl)piperazin-1-yl]ethanamine
CID 82166143
6-(4-propylpiperazin-1-yl)pyrimidin-4-amine
CID 78929729
2,4-dimethyl-5-[[4-(6-methylpyrimidin-4-yl)piperazin-1-yl]methyl]-1,3-thiazole
CID 155975428
2-[4-(6-methoxy-5-methylpyrimidin-4-yl)piperazin-1-yl]ethanamine
CID 66331325
4-[4-[(3-bromo-2-fluorophenyl)methyl]piperazin-1-yl]-6-methylpyrimidine
CID 171704326
2-methyl-3-[[4-(6-methylpyrimidin-4-yl)piperazin-1-yl]methyl]-4,5,6,7-tetrahydroindazole
CID 163348966
4-methyl-6-[4-(oxolan-3-ylmethyl)piperazin-1-yl]pyrimidine
CID 133335978
2-[4-(6-ethoxy-2-methylpyrimidin-4-yl)piperazin-1-yl]ethanamine
CID 66333920
4-[4-(2-fluorophenyl)piperazin-1-yl]-6-methylpyrimidine
CID 163351970

Frequently Asked Questions

What is the IUPAC name of 2-[4-(6-methylpyrimidin-4-yl)piperazin-1-yl]ethanamine?
The IUPAC name of 2-[4-(6-methylpyrimidin-4-yl)piperazin-1-yl]ethanamine (CID 61225493) is 2-[4-(6-methylpyrimidin-4-yl)piperazin-1-yl]ethanamine.
What is the SMILES notation for 2-[4-(6-methylpyrimidin-4-yl)piperazin-1-yl]ethanamine?
The canonical SMILES for 2-[4-(6-methylpyrimidin-4-yl)piperazin-1-yl]ethanamine is Cc1cc(N2CCN(CCN)CC2)ncn1.
What is the InChIKey of 2-[4-(6-methylpyrimidin-4-yl)piperazin-1-yl]ethanamine?
The InChIKey is SLPXCQZQBMADCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N5/c1-10-8-11(14-9-13-10)16-6-4-15(3-2-12)5-7-16/h8-9H,2-7,12H2,1H3.
What are the key properties of 2-[4-(6-methylpyrimidin-4-yl)piperazin-1-yl]ethanamine?
2-[4-(6-methylpyrimidin-4-yl)piperazin-1-yl]ethanamine has a molecular weight of 221.31 g/mol, XLogP of -0.13, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(6-methylpyrimidin-4-yl)piperazin-1-yl]ethanamine is sourced from PubChem (CID 61225493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).