4-[3-(methoxymethyl)piperidin-1-yl]-6-methyl-1,3,5-triazin-2-amine

C11H19N5O — CID 112746390

IUPAC4-[3-(methoxymethyl)piperidin-1-yl]-6-methyl-1,3,5-triazin-2-amine
SMILESCOCC1CCCN(c2nc(C)nc(N)n2)C1
InChIInChI=1S/C11H19N5O/c1-8-13-10(12)15-11(14-8)16-5-3-4-9(6-16)7-17-2/h9H,3-7H2,1-2H3,(H2,12,13,14,15)
InChIKeyLNTPIIDRWIPEEO-UHFFFAOYSA-N
MW237.31 g/mol
LogP0.63
Rot. Bonds3

About 4-[3-(methoxymethyl)piperidin-1-yl]-6-methyl-1,3,5-triazin-2-amine

4-[3-(methoxymethyl)piperidin-1-yl]-6-methyl-1,3,5-triazin-2-amine (PubChem CID 112746390) has the molecular formula C11H19N5O and a molecular weight of 237.31 g/mol. Its IUPAC name is 4-[3-(methoxymethyl)piperidin-1-yl]-6-methyl-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-[3-(methoxymethyl)piperidin-1-yl]-6-methyl-1,3,5-triazin-2-amine
PubChem CID112746390
Molecular FormulaC11H19N5O
Molecular Weight237.31 g/mol
Exact Mass237.16
IUPAC Name4-[3-(methoxymethyl)piperidin-1-yl]-6-methyl-1,3,5-triazin-2-amine
SMILESCOCC1CCCN(c2nc(C)nc(N)n2)C1
InChIInChI=1S/C11H19N5O/c1-8-13-10(12)15-11(14-8)16-5-3-4-9(6-16)7-17-2/h9H,3-7H2,1-2H3,(H2,12,13,14,15)
InChIKeyLNTPIIDRWIPEEO-UHFFFAOYSA-N
XLogP0.63
TPSA77.16 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.31
LogP ≤ 50.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-[3-(methoxymethyl)piperidin-1-yl]-6-methyl-1,3,5-triazin-2-amine?
The IUPAC name of 4-[3-(methoxymethyl)piperidin-1-yl]-6-methyl-1,3,5-triazin-2-amine (CID 112746390) is 4-[3-(methoxymethyl)piperidin-1-yl]-6-methyl-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-[3-(methoxymethyl)piperidin-1-yl]-6-methyl-1,3,5-triazin-2-amine?
The canonical SMILES for 4-[3-(methoxymethyl)piperidin-1-yl]-6-methyl-1,3,5-triazin-2-amine is COCC1CCCN(c2nc(C)nc(N)n2)C1.
What is the InChIKey of 4-[3-(methoxymethyl)piperidin-1-yl]-6-methyl-1,3,5-triazin-2-amine?
The InChIKey is LNTPIIDRWIPEEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N5O/c1-8-13-10(12)15-11(14-8)16-5-3-4-9(6-16)7-17-2/h9H,3-7H2,1-2H3,(H2,12,13,14,15).
What are the key properties of 4-[3-(methoxymethyl)piperidin-1-yl]-6-methyl-1,3,5-triazin-2-amine?
4-[3-(methoxymethyl)piperidin-1-yl]-6-methyl-1,3,5-triazin-2-amine has a molecular weight of 237.31 g/mol, XLogP of 0.63, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-(methoxymethyl)piperidin-1-yl]-6-methyl-1,3,5-triazin-2-amine is sourced from PubChem (CID 112746390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).