6-cyclopentyl-2-N,2-N,4-N-tris(methoxymethyl)-4-N-methyl-1,3,5-triazine-2,4-diamine

C15H27N5O3 — CID 58341525

IUPAC6-cyclopentyl-2-N,2-N,4-N-tris(methoxymethyl)-4-N-methyl-1,3,5-triazine-2,4-diamine
SMILESCOCN(C)c1nc(C2CCCC2)nc(N(COC)COC)n1
InChIInChI=1S/C15H27N5O3/c1-19(9-21-2)14-16-13(12-7-5-6-8-12)17-15(18-14)20(10-22-3)11-23-4/h12H,5-11H2,1-4H3
InChIKeyHTFCNHQPAUWYNQ-UHFFFAOYSA-N
MW325.41 g/mol
LogP1.58
Rot. Bonds9

About 6-cyclopentyl-2-N,2-N,4-N-tris(methoxymethyl)-4-N-methyl-1,3,5-triazine-2,4-diamine

6-cyclopentyl-2-N,2-N,4-N-tris(methoxymethyl)-4-N-methyl-1,3,5-triazine-2,4-diamine (PubChem CID 58341525) has the molecular formula C15H27N5O3 and a molecular weight of 325.41 g/mol. Its IUPAC name is 6-cyclopentyl-2-N,2-N,4-N-tris(methoxymethyl)-4-N-methyl-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name6-cyclopentyl-2-N,2-N,4-N-tris(methoxymethyl)-4-N-methyl-1,3,5-triazine-2,4-diamine
PubChem CID58341525
Molecular FormulaC15H27N5O3
Molecular Weight325.41 g/mol
Exact Mass325.21
IUPAC Name6-cyclopentyl-2-N,2-N,4-N-tris(methoxymethyl)-4-N-methyl-1,3,5-triazine-2,4-diamine
SMILESCOCN(C)c1nc(C2CCCC2)nc(N(COC)COC)n1
InChIInChI=1S/C15H27N5O3/c1-19(9-21-2)14-16-13(12-7-5-6-8-12)17-15(18-14)20(10-22-3)11-23-4/h12H,5-11H2,1-4H3
InChIKeyHTFCNHQPAUWYNQ-UHFFFAOYSA-N
XLogP1.58
TPSA72.84 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds9
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.41
LogP ≤ 51.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

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

Analyze 6-cyclopentyl-2-N,2-N,4-N-tris(methoxymethyl)-4-N-methyl-1,3,5-triazine-2,4-diamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-cyclopentyl-2-N,2-N,4-N-tris(methoxymethyl)-4-N-methyl-1,3,5-triazine-2,4-diamine?
The IUPAC name of 6-cyclopentyl-2-N,2-N,4-N-tris(methoxymethyl)-4-N-methyl-1,3,5-triazine-2,4-diamine (CID 58341525) is 6-cyclopentyl-2-N,2-N,4-N-tris(methoxymethyl)-4-N-methyl-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 6-cyclopentyl-2-N,2-N,4-N-tris(methoxymethyl)-4-N-methyl-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 6-cyclopentyl-2-N,2-N,4-N-tris(methoxymethyl)-4-N-methyl-1,3,5-triazine-2,4-diamine is COCN(C)c1nc(C2CCCC2)nc(N(COC)COC)n1.
What is the InChIKey of 6-cyclopentyl-2-N,2-N,4-N-tris(methoxymethyl)-4-N-methyl-1,3,5-triazine-2,4-diamine?
The InChIKey is HTFCNHQPAUWYNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N5O3/c1-19(9-21-2)14-16-13(12-7-5-6-8-12)17-15(18-14)20(10-22-3)11-23-4/h12H,5-11H2,1-4H3.
What are the key properties of 6-cyclopentyl-2-N,2-N,4-N-tris(methoxymethyl)-4-N-methyl-1,3,5-triazine-2,4-diamine?
6-cyclopentyl-2-N,2-N,4-N-tris(methoxymethyl)-4-N-methyl-1,3,5-triazine-2,4-diamine has a molecular weight of 325.41 g/mol, XLogP of 1.58, 9 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopentyl-2-N,2-N,4-N-tris(methoxymethyl)-4-N-methyl-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 58341525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).