6-[3-(methoxymethyl)piperidin-1-yl]-2-propan-2-ylpyrimidin-4-amine

C14H24N4O — CID 106590173

IUPAC6-[3-(methoxymethyl)piperidin-1-yl]-2-propan-2-ylpyrimidin-4-amine
SMILESCOCC1CCCN(c2cc(N)nc(C(C)C)n2)C1
InChIInChI=1S/C14H24N4O/c1-10(2)14-16-12(15)7-13(17-14)18-6-4-5-11(8-18)9-19-3/h7,10-11H,4-6,8-9H2,1-3H3,(H2,15,16,17)
InChIKeyYTDCWXCLYXMGIN-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.05
Rot. Bonds4

About 6-[3-(methoxymethyl)piperidin-1-yl]-2-propan-2-ylpyrimidin-4-amine

6-[3-(methoxymethyl)piperidin-1-yl]-2-propan-2-ylpyrimidin-4-amine (PubChem CID 106590173) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is 6-[3-(methoxymethyl)piperidin-1-yl]-2-propan-2-ylpyrimidin-4-amine.

Molecular Properties

Compound Name6-[3-(methoxymethyl)piperidin-1-yl]-2-propan-2-ylpyrimidin-4-amine
PubChem CID106590173
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC Name6-[3-(methoxymethyl)piperidin-1-yl]-2-propan-2-ylpyrimidin-4-amine
SMILESCOCC1CCCN(c2cc(N)nc(C(C)C)n2)C1
InChIInChI=1S/C14H24N4O/c1-10(2)14-16-12(15)7-13(17-14)18-6-4-5-11(8-18)9-19-3/h7,10-11H,4-6,8-9H2,1-3H3,(H2,15,16,17)
InChIKeyYTDCWXCLYXMGIN-UHFFFAOYSA-N
XLogP2.05
TPSA64.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-propan-2-yl-6-(3-propoxypiperidin-1-yl)pyrimidin-4-amine
CID 80961896
[2-[3-(methoxymethyl)piperidin-1-yl]-6-propan-2-yl-4-pyridinyl]methanamine
CID 106589236
6-[3-(methoxymethyl)piperidin-1-yl]-5-methyl-2-propan-2-ylpyrimidin-4-amine
CID 106590122
6-(3,4-dimethylpiperazin-1-yl)-2-propan-2-ylpyrimidin-4-amine
CID 80958087
6-(3-methoxy-4-methylpiperidin-1-yl)-2-propan-2-ylpyrimidin-4-amine
CID 102971409
4-[3-(methoxymethyl)piperidin-1-yl]-2-propan-2-yl-1H-pyrimidin-6-one
CID 136822001
[1-(6-hydrazinyl-2-propan-2-ylpyrimidin-4-yl)piperidin-3-yl]methanol
CID 80964876
6-[3-(methoxymethyl)pyrrolidin-1-yl]-2-propylpyrimidin-4-amine
CID 80949806
2-[3-(methoxymethyl)piperidin-1-yl]pyridin-4-amine
CID 106585882
4-[[1-(6-methyl-2-propan-2-ylpyrimidin-4-yl)piperidin-3-yl]methyl]morpholine
CID 133322391
6-[(3S)-3-(methoxymethyl)piperidin-1-yl]pyridin-3-amine
CID 129414410
6-(2-ethylpyrrolidin-1-yl)-2-propan-2-ylpyrimidin-4-amine
CID 80968032

Frequently Asked Questions

What is the IUPAC name of 6-[3-(methoxymethyl)piperidin-1-yl]-2-propan-2-ylpyrimidin-4-amine?
The IUPAC name of 6-[3-(methoxymethyl)piperidin-1-yl]-2-propan-2-ylpyrimidin-4-amine (CID 106590173) is 6-[3-(methoxymethyl)piperidin-1-yl]-2-propan-2-ylpyrimidin-4-amine.
What is the SMILES notation for 6-[3-(methoxymethyl)piperidin-1-yl]-2-propan-2-ylpyrimidin-4-amine?
The canonical SMILES for 6-[3-(methoxymethyl)piperidin-1-yl]-2-propan-2-ylpyrimidin-4-amine is COCC1CCCN(c2cc(N)nc(C(C)C)n2)C1.
What is the InChIKey of 6-[3-(methoxymethyl)piperidin-1-yl]-2-propan-2-ylpyrimidin-4-amine?
The InChIKey is YTDCWXCLYXMGIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O/c1-10(2)14-16-12(15)7-13(17-14)18-6-4-5-11(8-18)9-19-3/h7,10-11H,4-6,8-9H2,1-3H3,(H2,15,16,17).
What are the key properties of 6-[3-(methoxymethyl)piperidin-1-yl]-2-propan-2-ylpyrimidin-4-amine?
6-[3-(methoxymethyl)piperidin-1-yl]-2-propan-2-ylpyrimidin-4-amine has a molecular weight of 264.37 g/mol, XLogP of 2.05, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[3-(methoxymethyl)piperidin-1-yl]-2-propan-2-ylpyrimidin-4-amine is sourced from PubChem (CID 106590173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).