4-methoxy-6-[2-(1-methylpyrrolidin-2-yl)ethoxy]-1,3,5-triazin-2-amine

C11H19N5O2 — CID 80870804

IUPAC4-methoxy-6-[2-(1-methylpyrrolidin-2-yl)ethoxy]-1,3,5-triazin-2-amine
SMILESCOc1nc(N)nc(OCCC2CCCN2C)n1
InChIInChI=1S/C11H19N5O2/c1-16-6-3-4-8(16)5-7-18-11-14-9(12)13-10(15-11)17-2/h8H,3-7H2,1-2H3,(H2,12,13,14,15)
InChIKeyFHJZULKJOWOMFA-UHFFFAOYSA-N
MW253.31 g/mol
LogP0.33
Rot. Bonds5

About 4-methoxy-6-[2-(1-methylpyrrolidin-2-yl)ethoxy]-1,3,5-triazin-2-amine

4-methoxy-6-[2-(1-methylpyrrolidin-2-yl)ethoxy]-1,3,5-triazin-2-amine (PubChem CID 80870804) has the molecular formula C11H19N5O2 and a molecular weight of 253.31 g/mol. Its IUPAC name is 4-methoxy-6-[2-(1-methylpyrrolidin-2-yl)ethoxy]-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-methoxy-6-[2-(1-methylpyrrolidin-2-yl)ethoxy]-1,3,5-triazin-2-amine
PubChem CID80870804
Molecular FormulaC11H19N5O2
Molecular Weight253.31 g/mol
Exact Mass253.15
IUPAC Name4-methoxy-6-[2-(1-methylpyrrolidin-2-yl)ethoxy]-1,3,5-triazin-2-amine
SMILESCOc1nc(N)nc(OCCC2CCCN2C)n1
InChIInChI=1S/C11H19N5O2/c1-16-6-3-4-8(16)5-7-18-11-14-9(12)13-10(15-11)17-2/h8H,3-7H2,1-2H3,(H2,12,13,14,15)
InChIKeyFHJZULKJOWOMFA-UHFFFAOYSA-N
XLogP0.33
TPSA86.39 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.31
LogP ≤ 50.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

4-[2-(1-methylpyrrolidin-2-yl)ethoxy]-6-(1,2,4-triazol-1-yl)-1,3,5-triazin-2-amine
CID 80879284
6-methoxy-2-N-methyl-2-N-[(1-methylpyrrolidin-2-yl)methyl]-1,3,5-triazine-2,4-diamine
CID 80848203
6-ethoxy-2-N-methyl-2-N-[(1-methylpyrrolidin-2-yl)methyl]-1,3,5-triazine-2,4-diamine
CID 80848516
4-[2-(1-methylpyrrolidin-2-yl)ethoxy]-6-(trifluoromethyl)pyrimidin-2-amine
CID 114566419
6-[2-(1-methylpyrrolidin-2-yl)ethoxy]pyrazin-2-amine
CID 80648161
4-methoxy-6-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-1,3,5-triazin-2-amine
CID 104568131
4-methoxy-6-[2-(2-methoxyethoxy)ethoxy]-1,3,5-triazin-2-amine
CID 113427586
2-[(4-amino-6-methoxy-1,3,5-triazin-2-yl)oxy]ethanol
CID 80859663
4-methyl-6-[2-(1-methylpyrrolidin-2-yl)ethyl]pyrimidin-2-amine
CID 68982243
2-N-[(1-ethylpyrrolidin-2-yl)methyl]-2-N-methyl-6-propoxy-1,3,5-triazine-2,4-diamine
CID 80835031
8-[2-(1-methylpyrrolidin-2-yl)ethoxy]quinolin-2-amine
CID 22254585
2-[2-(3-methoxyphenoxy)ethyl]-1-methylpiperidine
CID 70628177

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-6-[2-(1-methylpyrrolidin-2-yl)ethoxy]-1,3,5-triazin-2-amine?
The IUPAC name of 4-methoxy-6-[2-(1-methylpyrrolidin-2-yl)ethoxy]-1,3,5-triazin-2-amine (CID 80870804) is 4-methoxy-6-[2-(1-methylpyrrolidin-2-yl)ethoxy]-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-methoxy-6-[2-(1-methylpyrrolidin-2-yl)ethoxy]-1,3,5-triazin-2-amine?
The canonical SMILES for 4-methoxy-6-[2-(1-methylpyrrolidin-2-yl)ethoxy]-1,3,5-triazin-2-amine is COc1nc(N)nc(OCCC2CCCN2C)n1.
What is the InChIKey of 4-methoxy-6-[2-(1-methylpyrrolidin-2-yl)ethoxy]-1,3,5-triazin-2-amine?
The InChIKey is FHJZULKJOWOMFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N5O2/c1-16-6-3-4-8(16)5-7-18-11-14-9(12)13-10(15-11)17-2/h8H,3-7H2,1-2H3,(H2,12,13,14,15).
What are the key properties of 4-methoxy-6-[2-(1-methylpyrrolidin-2-yl)ethoxy]-1,3,5-triazin-2-amine?
4-methoxy-6-[2-(1-methylpyrrolidin-2-yl)ethoxy]-1,3,5-triazin-2-amine has a molecular weight of 253.31 g/mol, XLogP of 0.33, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-6-[2-(1-methylpyrrolidin-2-yl)ethoxy]-1,3,5-triazin-2-amine is sourced from PubChem (CID 80870804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).