6-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]-5-methylpyrimidin-4-amine

C13H24N6 — CID 80825002

IUPAC6-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]-5-methylpyrimidin-4-amine
SMILESCc1c(N)ncnc1N1CCN(CCN(C)C)CC1
InChIInChI=1S/C13H24N6/c1-11-12(14)15-10-16-13(11)19-8-6-18(7-9-19)5-4-17(2)3/h10H,4-9H2,1-3H3,(H2,14,15,16)
InChIKeyUAYFXLCRNNSQQK-UHFFFAOYSA-N
MW264.38 g/mol
LogP0.05
Rot. Bonds4

About 6-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]-5-methylpyrimidin-4-amine

6-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]-5-methylpyrimidin-4-amine (PubChem CID 80825002) has the molecular formula C13H24N6 and a molecular weight of 264.38 g/mol. Its IUPAC name is 6-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]-5-methylpyrimidin-4-amine.

Molecular Properties

Compound Name6-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]-5-methylpyrimidin-4-amine
PubChem CID80825002
Molecular FormulaC13H24N6
Molecular Weight264.38 g/mol
Exact Mass264.21
IUPAC Name6-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]-5-methylpyrimidin-4-amine
SMILESCc1c(N)ncnc1N1CCN(CCN(C)C)CC1
InChIInChI=1S/C13H24N6/c1-11-12(14)15-10-16-13(11)19-8-6-18(7-9-19)5-4-17(2)3/h10H,4-9H2,1-3H3,(H2,14,15,16)
InChIKeyUAYFXLCRNNSQQK-UHFFFAOYSA-N
XLogP0.05
TPSA61.52 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.38
LogP ≤ 50.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

5-methyl-6-(4-propylpiperazin-1-yl)pyrimidin-4-amine
CID 80757172
5-methyl-6-[4-(2-methylpropyl)piperazin-1-yl]pyrimidin-4-amine
CID 80824589
5-methyl-6-pyrrolidin-1-ylpyrimidin-4-amine
CID 80767389
6-(4,4-dimethylpiperidin-1-yl)-5-methylpyrimidin-4-amine
CID 80823749
6-(4-cyclopropylpiperazin-1-yl)-5-methylpyrimidin-4-amine
CID 80799407
6-(4,4-diethylpiperidin-1-yl)-5-methylpyrimidin-4-amine
CID 80831059
1-(6-amino-5-methylpyrimidin-4-yl)-4-methylpiperidin-4-ol
CID 81108883
6-(3-ethyl-4-methylpiperazin-1-yl)-5-methylpyrimidin-4-amine
CID 80834116
2-[4-[4-(aminomethyl)-5,6-dimethylpyridazin-3-yl]piperazin-1-yl]-N,N-dimethylethanamine
CID 62886758
2-[4-(5,6-diaminopyrimidin-4-yl)piperazin-1-yl]ethanol
CID 19137084
5-methyl-6-[4-(1,3-thiazol-2-yl)piperazin-1-yl]pyrimidin-4-amine
CID 80754526
5-methyl-6-(1,4-thiazepan-4-yl)pyrimidin-4-amine
CID 80795248

Frequently Asked Questions

What is the IUPAC name of 6-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]-5-methylpyrimidin-4-amine?
The IUPAC name of 6-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]-5-methylpyrimidin-4-amine (CID 80825002) is 6-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]-5-methylpyrimidin-4-amine.
What is the SMILES notation for 6-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]-5-methylpyrimidin-4-amine?
The canonical SMILES for 6-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]-5-methylpyrimidin-4-amine is Cc1c(N)ncnc1N1CCN(CCN(C)C)CC1.
What is the InChIKey of 6-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]-5-methylpyrimidin-4-amine?
The InChIKey is UAYFXLCRNNSQQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N6/c1-11-12(14)15-10-16-13(11)19-8-6-18(7-9-19)5-4-17(2)3/h10H,4-9H2,1-3H3,(H2,14,15,16).
What are the key properties of 6-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]-5-methylpyrimidin-4-amine?
6-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]-5-methylpyrimidin-4-amine has a molecular weight of 264.38 g/mol, XLogP of 0.05, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]-5-methylpyrimidin-4-amine is sourced from PubChem (CID 80825002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).