1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-N-(2-methylbutan-2-yl)piperidine-4-carboxamide

C16H27N5O3 — CID 3222669

IUPAC1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-N-(2-methylbutan-2-yl)piperidine-4-carboxamide
SMILESCCC(C)(C)NC(=O)C1CCN(c2nc(OC)nc(OC)n2)CC1
InChIInChI=1S/C16H27N5O3/c1-6-16(2,3)20-12(22)11-7-9-21(10-8-11)13-17-14(23-4)19-15(18-13)24-5/h11H,6-10H2,1-5H3,(H,20,22)
InChIKeyHJTQQLBUIYFVJP-UHFFFAOYSA-N
MW337.42 g/mol
LogP1.41
Rot. Bonds6

About 1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-N-(2-methylbutan-2-yl)piperidine-4-carboxamide

1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-N-(2-methylbutan-2-yl)piperidine-4-carboxamide (PubChem CID 3222669) has the molecular formula C16H27N5O3 and a molecular weight of 337.42 g/mol. Its IUPAC name is 1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-N-(2-methylbutan-2-yl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-N-(2-methylbutan-2-yl)piperidine-4-carboxamide
PubChem CID3222669
Molecular FormulaC16H27N5O3
Molecular Weight337.42 g/mol
Exact Mass337.21
IUPAC Name1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-N-(2-methylbutan-2-yl)piperidine-4-carboxamide
SMILESCCC(C)(C)NC(=O)C1CCN(c2nc(OC)nc(OC)n2)CC1
InChIInChI=1S/C16H27N5O3/c1-6-16(2,3)20-12(22)11-7-9-21(10-8-11)13-17-14(23-4)19-15(18-13)24-5/h11H,6-10H2,1-5H3,(H,20,22)
InChIKeyHJTQQLBUIYFVJP-UHFFFAOYSA-N
XLogP1.41
TPSA89.47 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.42
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-N-(2-methylbutan-2-yl)piperidine-4-carboxamide 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 1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-N-(2-methylbutan-2-yl)piperidine-4-carboxamide?
The IUPAC name of 1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-N-(2-methylbutan-2-yl)piperidine-4-carboxamide (CID 3222669) is 1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-N-(2-methylbutan-2-yl)piperidine-4-carboxamide.
What is the SMILES notation for 1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-N-(2-methylbutan-2-yl)piperidine-4-carboxamide?
The canonical SMILES for 1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-N-(2-methylbutan-2-yl)piperidine-4-carboxamide is CCC(C)(C)NC(=O)C1CCN(c2nc(OC)nc(OC)n2)CC1.
What is the InChIKey of 1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-N-(2-methylbutan-2-yl)piperidine-4-carboxamide?
The InChIKey is HJTQQLBUIYFVJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N5O3/c1-6-16(2,3)20-12(22)11-7-9-21(10-8-11)13-17-14(23-4)19-15(18-13)24-5/h11H,6-10H2,1-5H3,(H,20,22).
What are the key properties of 1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-N-(2-methylbutan-2-yl)piperidine-4-carboxamide?
1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-N-(2-methylbutan-2-yl)piperidine-4-carboxamide has a molecular weight of 337.42 g/mol, XLogP of 1.41, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-N-(2-methylbutan-2-yl)piperidine-4-carboxamide is sourced from PubChem (CID 3222669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).