4-cyclopentyl-6-(2-methoxyethyl)-N-(methoxymethyl)-N-methyl-1,3,5-triazin-2-amine

C14H24N4O2 — CID 58341517

IUPAC4-cyclopentyl-6-(2-methoxyethyl)-N-(methoxymethyl)-N-methyl-1,3,5-triazin-2-amine
SMILESCOCCc1nc(C2CCCC2)nc(N(C)COC)n1
InChIInChI=1S/C14H24N4O2/c1-18(10-20-3)14-16-12(8-9-19-2)15-13(17-14)11-6-4-5-7-11/h11H,4-10H2,1-3H3
InChIKeyAEMRFKTVKARLSO-UHFFFAOYSA-N
MW280.37 g/mol
LogP1.76
Rot. Bonds7

About 4-cyclopentyl-6-(2-methoxyethyl)-N-(methoxymethyl)-N-methyl-1,3,5-triazin-2-amine

4-cyclopentyl-6-(2-methoxyethyl)-N-(methoxymethyl)-N-methyl-1,3,5-triazin-2-amine (PubChem CID 58341517) has the molecular formula C14H24N4O2 and a molecular weight of 280.37 g/mol. Its IUPAC name is 4-cyclopentyl-6-(2-methoxyethyl)-N-(methoxymethyl)-N-methyl-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-cyclopentyl-6-(2-methoxyethyl)-N-(methoxymethyl)-N-methyl-1,3,5-triazin-2-amine
PubChem CID58341517
Molecular FormulaC14H24N4O2
Molecular Weight280.37 g/mol
Exact Mass280.19
IUPAC Name4-cyclopentyl-6-(2-methoxyethyl)-N-(methoxymethyl)-N-methyl-1,3,5-triazin-2-amine
SMILESCOCCc1nc(C2CCCC2)nc(N(C)COC)n1
InChIInChI=1S/C14H24N4O2/c1-18(10-20-3)14-16-12(8-9-19-2)15-13(17-14)11-6-4-5-7-11/h11H,4-10H2,1-3H3
InChIKeyAEMRFKTVKARLSO-UHFFFAOYSA-N
XLogP1.76
TPSA60.37 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 51.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-cyclopentyl-6-(2-methoxyethyl)-N-(methoxymethyl)-N-methyl-1,3,5-triazin-2-amine?
The IUPAC name of 4-cyclopentyl-6-(2-methoxyethyl)-N-(methoxymethyl)-N-methyl-1,3,5-triazin-2-amine (CID 58341517) is 4-cyclopentyl-6-(2-methoxyethyl)-N-(methoxymethyl)-N-methyl-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-cyclopentyl-6-(2-methoxyethyl)-N-(methoxymethyl)-N-methyl-1,3,5-triazin-2-amine?
The canonical SMILES for 4-cyclopentyl-6-(2-methoxyethyl)-N-(methoxymethyl)-N-methyl-1,3,5-triazin-2-amine is COCCc1nc(C2CCCC2)nc(N(C)COC)n1.
What is the InChIKey of 4-cyclopentyl-6-(2-methoxyethyl)-N-(methoxymethyl)-N-methyl-1,3,5-triazin-2-amine?
The InChIKey is AEMRFKTVKARLSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O2/c1-18(10-20-3)14-16-12(8-9-19-2)15-13(17-14)11-6-4-5-7-11/h11H,4-10H2,1-3H3.
What are the key properties of 4-cyclopentyl-6-(2-methoxyethyl)-N-(methoxymethyl)-N-methyl-1,3,5-triazin-2-amine?
4-cyclopentyl-6-(2-methoxyethyl)-N-(methoxymethyl)-N-methyl-1,3,5-triazin-2-amine has a molecular weight of 280.37 g/mol, XLogP of 1.76, 7 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopentyl-6-(2-methoxyethyl)-N-(methoxymethyl)-N-methyl-1,3,5-triazin-2-amine is sourced from PubChem (CID 58341517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).