1-(4,6-dimethyl-2-piperidin-1-ylpyrimidin-5-yl)-N-methylmethanamine

C13H22N4 — CID 62745478

IUPAC1-(4,6-dimethyl-2-piperidin-1-ylpyrimidin-5-yl)-N-methylmethanamine
SMILESCNCc1c(C)nc(N2CCCCC2)nc1C
InChIInChI=1S/C13H22N4/c1-10-12(9-14-3)11(2)16-13(15-10)17-7-5-4-6-8-17/h14H,4-9H2,1-3H3
InChIKeyIIYXUEQFYHQFJL-UHFFFAOYSA-N
MW234.35 g/mol
LogP1.80
Rot. Bonds3

About 1-(4,6-dimethyl-2-piperidin-1-ylpyrimidin-5-yl)-N-methylmethanamine

1-(4,6-dimethyl-2-piperidin-1-ylpyrimidin-5-yl)-N-methylmethanamine (PubChem CID 62745478) has the molecular formula C13H22N4 and a molecular weight of 234.35 g/mol. Its IUPAC name is 1-(4,6-dimethyl-2-piperidin-1-ylpyrimidin-5-yl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(4,6-dimethyl-2-piperidin-1-ylpyrimidin-5-yl)-N-methylmethanamine
PubChem CID62745478
Molecular FormulaC13H22N4
Molecular Weight234.35 g/mol
Exact Mass234.18
IUPAC Name1-(4,6-dimethyl-2-piperidin-1-ylpyrimidin-5-yl)-N-methylmethanamine
SMILESCNCc1c(C)nc(N2CCCCC2)nc1C
InChIInChI=1S/C13H22N4/c1-10-12(9-14-3)11(2)16-13(15-10)17-7-5-4-6-8-17/h14H,4-9H2,1-3H3
InChIKeyIIYXUEQFYHQFJL-UHFFFAOYSA-N
XLogP1.80
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.35
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(4,6-dimethyl-2-piperidin-1-ylpyrimidin-5-yl)methyl]-2-methylpropan-2-amine
CID 62746380
3-(4,6-dimethyl-2-pyrrolidin-1-ylpyrimidin-5-yl)-N-methylpropan-1-amine
CID 62745440
N-[[2-(azepan-1-yl)-4,6-dimethylpyrimidin-5-yl]methyl]-2-methylpropan-1-amine
CID 62746715
5-ethyl-N,6-dimethyl-2-piperidin-1-ylpyrimidin-4-amine
CID 62190547
(4,6-dimethyl-2-pyrrolidin-1-ylpyrimidin-5-yl)methanamine;hydrochloride
CID 82021870
3-(4,6-dimethyl-2-piperidin-1-ylpyrimidin-5-yl)propan-1-amine
CID 55113725
N-[3-(4,6-dimethyl-2-piperidin-1-ylpyrimidin-5-yl)propyl]cyclopropanamine
CID 62744044
3-[2-(azepan-1-yl)-4,6-dimethylpyrimidin-5-yl]-2-methylpropan-1-amine
CID 65293619
N-methyl-1-(2-methyl-5-piperidin-1-yl-1,2,4-triazol-3-yl)methanamine
CID 83884678
2,4,6-tri(piperidin-1-yl)-1,3,5-triazine
CID 2827031
2-(4,6-diethyl-2-piperidin-1-ylpyrimidin-5-yl)-N-methylethanamine
CID 79219149
N-methyl-1-(2-piperidin-1-ylpyrimidin-5-yl)methanamine
CID 62756397

Frequently Asked Questions

What is the IUPAC name of 1-(4,6-dimethyl-2-piperidin-1-ylpyrimidin-5-yl)-N-methylmethanamine?
The IUPAC name of 1-(4,6-dimethyl-2-piperidin-1-ylpyrimidin-5-yl)-N-methylmethanamine (CID 62745478) is 1-(4,6-dimethyl-2-piperidin-1-ylpyrimidin-5-yl)-N-methylmethanamine.
What is the SMILES notation for 1-(4,6-dimethyl-2-piperidin-1-ylpyrimidin-5-yl)-N-methylmethanamine?
The canonical SMILES for 1-(4,6-dimethyl-2-piperidin-1-ylpyrimidin-5-yl)-N-methylmethanamine is CNCc1c(C)nc(N2CCCCC2)nc1C.
What is the InChIKey of 1-(4,6-dimethyl-2-piperidin-1-ylpyrimidin-5-yl)-N-methylmethanamine?
The InChIKey is IIYXUEQFYHQFJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4/c1-10-12(9-14-3)11(2)16-13(15-10)17-7-5-4-6-8-17/h14H,4-9H2,1-3H3.
What are the key properties of 1-(4,6-dimethyl-2-piperidin-1-ylpyrimidin-5-yl)-N-methylmethanamine?
1-(4,6-dimethyl-2-piperidin-1-ylpyrimidin-5-yl)-N-methylmethanamine has a molecular weight of 234.35 g/mol, XLogP of 1.80, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4,6-dimethyl-2-piperidin-1-ylpyrimidin-5-yl)-N-methylmethanamine is sourced from PubChem (CID 62745478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).