6-(4,4-dimethylpiperidin-1-yl)-N-methylpyrimidin-4-amine

C12H20N4 — CID 80823841

IUPAC6-(4,4-dimethylpiperidin-1-yl)-N-methylpyrimidin-4-amine
SMILESCNc1cc(N2CCC(C)(C)CC2)ncn1
InChIInChI=1S/C12H20N4/c1-12(2)4-6-16(7-5-12)11-8-10(13-3)14-9-15-11/h8-9H,4-7H2,1-3H3,(H,13,14,15)
InChIKeyONJWPZYJAHSZCH-UHFFFAOYSA-N
MW220.32 g/mol
LogP2.14
Rot. Bonds2

About 6-(4,4-dimethylpiperidin-1-yl)-N-methylpyrimidin-4-amine

6-(4,4-dimethylpiperidin-1-yl)-N-methylpyrimidin-4-amine (PubChem CID 80823841) has the molecular formula C12H20N4 and a molecular weight of 220.32 g/mol. Its IUPAC name is 6-(4,4-dimethylpiperidin-1-yl)-N-methylpyrimidin-4-amine.

Molecular Properties

Compound Name6-(4,4-dimethylpiperidin-1-yl)-N-methylpyrimidin-4-amine
PubChem CID80823841
Molecular FormulaC12H20N4
Molecular Weight220.32 g/mol
Exact Mass220.17
IUPAC Name6-(4,4-dimethylpiperidin-1-yl)-N-methylpyrimidin-4-amine
SMILESCNc1cc(N2CCC(C)(C)CC2)ncn1
InChIInChI=1S/C12H20N4/c1-12(2)4-6-16(7-5-12)11-8-10(13-3)14-9-15-11/h8-9H,4-7H2,1-3H3,(H,13,14,15)
InChIKeyONJWPZYJAHSZCH-UHFFFAOYSA-N
XLogP2.14
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-methyl-1-[6-(methylamino)pyrimidin-4-yl]piperidin-4-ol
CID 81109322
[1-[6-(methylamino)pyrimidin-4-yl]piperidin-4-yl]methanol
CID 80755881
4,4-dimethyl-1-(6-piperidin-1-ylpyrimidin-4-yl)azepane
CID 133323337
N-methyl-6-(4-phenylpiperazin-1-yl)pyrimidin-4-amine
CID 80754206
2-[6-(methylamino)pyrimidin-4-yl]-1,3,4,5,6,7,8,8a-octahydroisoquinolin-4a-ol
CID 81108540
6-(3,4-dimethylpyrrolidin-1-yl)-N-methylpyrimidin-4-amine
CID 80848167
N-methyl-6-[4-(2-methylpropyl)piperazin-1-yl]pyrimidin-4-amine
CID 80825091
6-[4-(2-methoxypropan-2-yl)piperidin-1-yl]-N-methylpyrimidin-4-amine
CID 166315850
1-[6-(methylamino)pyrimidin-4-yl]azetidin-3-ol
CID 121206025
1-(6-fluoropyrimidin-4-yl)-4,4-dimethylazepane
CID 115417100
N-methyl-6-[4-(6-phenylpyrimidin-4-yl)piperazin-1-yl]pyrimidin-4-amine
CID 122281848
6-(1,3-dihydroisoindol-2-yl)-N-methylpyrimidin-4-amine
CID 80822585

Frequently Asked Questions

What is the IUPAC name of 6-(4,4-dimethylpiperidin-1-yl)-N-methylpyrimidin-4-amine?
The IUPAC name of 6-(4,4-dimethylpiperidin-1-yl)-N-methylpyrimidin-4-amine (CID 80823841) is 6-(4,4-dimethylpiperidin-1-yl)-N-methylpyrimidin-4-amine.
What is the SMILES notation for 6-(4,4-dimethylpiperidin-1-yl)-N-methylpyrimidin-4-amine?
The canonical SMILES for 6-(4,4-dimethylpiperidin-1-yl)-N-methylpyrimidin-4-amine is CNc1cc(N2CCC(C)(C)CC2)ncn1.
What is the InChIKey of 6-(4,4-dimethylpiperidin-1-yl)-N-methylpyrimidin-4-amine?
The InChIKey is ONJWPZYJAHSZCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4/c1-12(2)4-6-16(7-5-12)11-8-10(13-3)14-9-15-11/h8-9H,4-7H2,1-3H3,(H,13,14,15).
What are the key properties of 6-(4,4-dimethylpiperidin-1-yl)-N-methylpyrimidin-4-amine?
6-(4,4-dimethylpiperidin-1-yl)-N-methylpyrimidin-4-amine has a molecular weight of 220.32 g/mol, XLogP of 2.14, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4,4-dimethylpiperidin-1-yl)-N-methylpyrimidin-4-amine is sourced from PubChem (CID 80823841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).