6-[4-(methoxymethyl)piperidin-1-yl]-N,5-dimethyl-2-propylpyrimidin-4-amine

C16H28N4O — CID 80984787

IUPAC6-[4-(methoxymethyl)piperidin-1-yl]-N,5-dimethyl-2-propylpyrimidin-4-amine
SMILESCCCc1nc(NC)c(C)c(N2CCC(COC)CC2)n1
InChIInChI=1S/C16H28N4O/c1-5-6-14-18-15(17-3)12(2)16(19-14)20-9-7-13(8-10-20)11-21-4/h13H,5-11H2,1-4H3,(H,17,18,19)
InChIKeyHBHBOYLEONBOHZ-UHFFFAOYSA-N
MW292.43 g/mol
LogP2.64
Rot. Bonds6

About 6-[4-(methoxymethyl)piperidin-1-yl]-N,5-dimethyl-2-propylpyrimidin-4-amine

6-[4-(methoxymethyl)piperidin-1-yl]-N,5-dimethyl-2-propylpyrimidin-4-amine (PubChem CID 80984787) has the molecular formula C16H28N4O and a molecular weight of 292.43 g/mol. Its IUPAC name is 6-[4-(methoxymethyl)piperidin-1-yl]-N,5-dimethyl-2-propylpyrimidin-4-amine.

Molecular Properties

Compound Name6-[4-(methoxymethyl)piperidin-1-yl]-N,5-dimethyl-2-propylpyrimidin-4-amine
PubChem CID80984787
Molecular FormulaC16H28N4O
Molecular Weight292.43 g/mol
Exact Mass292.23
IUPAC Name6-[4-(methoxymethyl)piperidin-1-yl]-N,5-dimethyl-2-propylpyrimidin-4-amine
SMILESCCCc1nc(NC)c(C)c(N2CCC(COC)CC2)n1
InChIInChI=1S/C16H28N4O/c1-5-6-14-18-15(17-3)12(2)16(19-14)20-9-7-13(8-10-20)11-21-4/h13H,5-11H2,1-4H3,(H,17,18,19)
InChIKeyHBHBOYLEONBOHZ-UHFFFAOYSA-N
XLogP2.64
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.43
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-N,5-dimethyl-2-propylpyrimidin-4-amine
CID 104961762
N,5-dimethyl-6-(2-methylazepan-1-yl)-2-propylpyrimidin-4-amine
CID 80985513
6-(4-ethylpiperidin-1-yl)-N,2,5-trimethylpyrimidin-4-amine
CID 80795154
6-[4-(dimethylamino)piperidin-1-yl]-2-ethyl-N,5-dimethylpyrimidin-4-amine
CID 80993261
1-[5-methyl-2-propyl-6-(propylamino)pyrimidin-4-yl]piperidin-4-ol
CID 80981249
6-(2,3-dimethylpiperidin-1-yl)-N,5-dimethyl-2-propylpyrimidin-4-amine
CID 80982926
1-[6-(ethylamino)-5-methyl-2-propylpyrimidin-4-yl]-3-methylpiperidin-4-ol
CID 114683989
[1-(6-amino-5-methyl-2-propylpyrimidin-4-yl)piperidin-4-yl]methanol
CID 80977068
6-[3-(methoxymethyl)piperidin-1-yl]-N,5-dimethyl-2-propan-2-ylpyrimidin-4-amine
CID 106590209
2-ethyl-N,5-dimethyl-6-piperazin-1-ylpyrimidin-4-amine
CID 80983428
6-N,5-dimethyl-4-N-(2-methylcyclopentyl)-2-propylpyrimidine-4,6-diamine
CID 80985581
6-[4-[(dimethylamino)methyl]piperidin-1-yl]-N,2,5-trimethylpyrimidin-4-amine
CID 80805607

Frequently Asked Questions

What is the IUPAC name of 6-[4-(methoxymethyl)piperidin-1-yl]-N,5-dimethyl-2-propylpyrimidin-4-amine?
The IUPAC name of 6-[4-(methoxymethyl)piperidin-1-yl]-N,5-dimethyl-2-propylpyrimidin-4-amine (CID 80984787) is 6-[4-(methoxymethyl)piperidin-1-yl]-N,5-dimethyl-2-propylpyrimidin-4-amine.
What is the SMILES notation for 6-[4-(methoxymethyl)piperidin-1-yl]-N,5-dimethyl-2-propylpyrimidin-4-amine?
The canonical SMILES for 6-[4-(methoxymethyl)piperidin-1-yl]-N,5-dimethyl-2-propylpyrimidin-4-amine is CCCc1nc(NC)c(C)c(N2CCC(COC)CC2)n1.
What is the InChIKey of 6-[4-(methoxymethyl)piperidin-1-yl]-N,5-dimethyl-2-propylpyrimidin-4-amine?
The InChIKey is HBHBOYLEONBOHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N4O/c1-5-6-14-18-15(17-3)12(2)16(19-14)20-9-7-13(8-10-20)11-21-4/h13H,5-11H2,1-4H3,(H,17,18,19).
What are the key properties of 6-[4-(methoxymethyl)piperidin-1-yl]-N,5-dimethyl-2-propylpyrimidin-4-amine?
6-[4-(methoxymethyl)piperidin-1-yl]-N,5-dimethyl-2-propylpyrimidin-4-amine has a molecular weight of 292.43 g/mol, XLogP of 2.64, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-(methoxymethyl)piperidin-1-yl]-N,5-dimethyl-2-propylpyrimidin-4-amine is sourced from PubChem (CID 80984787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).