N-[4,6-bis[acetyl(ethyl)amino]-1,3,5-triazin-2-yl]-N-ethylacetamide

C15H24N6O3 — CID 172799618

IUPACN-[4,6-bis[acetyl(ethyl)amino]-1,3,5-triazin-2-yl]-N-ethylacetamide
SMILESCCN(C(C)=O)c1nc(N(CC)C(C)=O)nc(N(CC)C(C)=O)n1
InChIInChI=1S/C15H24N6O3/c1-7-19(10(4)22)13-16-14(20(8-2)11(5)23)18-15(17-13)21(9-3)12(6)24/h7-9H2,1-6H3
InChIKeyQRJSWJLBMHOPBG-UHFFFAOYSA-N
MW336.40 g/mol
LogP0.99
Rot. Bonds6

About N-[4,6-bis[acetyl(ethyl)amino]-1,3,5-triazin-2-yl]-N-ethylacetamide

N-[4,6-bis[acetyl(ethyl)amino]-1,3,5-triazin-2-yl]-N-ethylacetamide (PubChem CID 172799618) has the molecular formula C15H24N6O3 and a molecular weight of 336.40 g/mol. Its IUPAC name is N-[4,6-bis[acetyl(ethyl)amino]-1,3,5-triazin-2-yl]-N-ethylacetamide.

Molecular Properties

Compound NameN-[4,6-bis[acetyl(ethyl)amino]-1,3,5-triazin-2-yl]-N-ethylacetamide
PubChem CID172799618
Molecular FormulaC15H24N6O3
Molecular Weight336.40 g/mol
Exact Mass336.19
IUPAC NameN-[4,6-bis[acetyl(ethyl)amino]-1,3,5-triazin-2-yl]-N-ethylacetamide
SMILESCCN(C(C)=O)c1nc(N(CC)C(C)=O)nc(N(CC)C(C)=O)n1
InChIInChI=1S/C15H24N6O3/c1-7-19(10(4)22)13-16-14(20(8-2)11(5)23)18-15(17-13)21(9-3)12(6)24/h7-9H2,1-6H3
InChIKeyQRJSWJLBMHOPBG-UHFFFAOYSA-N
XLogP0.99
TPSA99.60 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.40
LogP ≤ 50.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze N-[4,6-bis[acetyl(ethyl)amino]-1,3,5-triazin-2-yl]-N-ethylacetamide 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 N-[4,6-bis[acetyl(ethyl)amino]-1,3,5-triazin-2-yl]-N-ethylacetamide?
The IUPAC name of N-[4,6-bis[acetyl(ethyl)amino]-1,3,5-triazin-2-yl]-N-ethylacetamide (CID 172799618) is N-[4,6-bis[acetyl(ethyl)amino]-1,3,5-triazin-2-yl]-N-ethylacetamide.
What is the SMILES notation for N-[4,6-bis[acetyl(ethyl)amino]-1,3,5-triazin-2-yl]-N-ethylacetamide?
The canonical SMILES for N-[4,6-bis[acetyl(ethyl)amino]-1,3,5-triazin-2-yl]-N-ethylacetamide is CCN(C(C)=O)c1nc(N(CC)C(C)=O)nc(N(CC)C(C)=O)n1.
What is the InChIKey of N-[4,6-bis[acetyl(ethyl)amino]-1,3,5-triazin-2-yl]-N-ethylacetamide?
The InChIKey is QRJSWJLBMHOPBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N6O3/c1-7-19(10(4)22)13-16-14(20(8-2)11(5)23)18-15(17-13)21(9-3)12(6)24/h7-9H2,1-6H3.
What are the key properties of N-[4,6-bis[acetyl(ethyl)amino]-1,3,5-triazin-2-yl]-N-ethylacetamide?
N-[4,6-bis[acetyl(ethyl)amino]-1,3,5-triazin-2-yl]-N-ethylacetamide has a molecular weight of 336.40 g/mol, XLogP of 0.99, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4,6-bis[acetyl(ethyl)amino]-1,3,5-triazin-2-yl]-N-ethylacetamide is sourced from PubChem (CID 172799618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).