N-[1-(4,6-dimethoxy-1,3,5-triazin-2-yl)piperidin-4-yl]cyclobutanecarboxamide

C15H23N5O3 — CID 163357717

IUPACN-[1-(4,6-dimethoxy-1,3,5-triazin-2-yl)piperidin-4-yl]cyclobutanecarboxamide
SMILESCOc1nc(OC)nc(N2CCC(NC(=O)C3CCC3)CC2)n1
InChIInChI=1S/C15H23N5O3/c1-22-14-17-13(18-15(19-14)23-2)20-8-6-11(7-9-20)16-12(21)10-4-3-5-10/h10-11H,3-9H2,1-2H3,(H,16,21)
InChIKeyHPHYCUSTXRXSCI-UHFFFAOYSA-N
MW321.38 g/mol
LogP0.77
Rot. Bonds5

About N-[1-(4,6-dimethoxy-1,3,5-triazin-2-yl)piperidin-4-yl]cyclobutanecarboxamide

N-[1-(4,6-dimethoxy-1,3,5-triazin-2-yl)piperidin-4-yl]cyclobutanecarboxamide (PubChem CID 163357717) has the molecular formula C15H23N5O3 and a molecular weight of 321.38 g/mol. Its IUPAC name is N-[1-(4,6-dimethoxy-1,3,5-triazin-2-yl)piperidin-4-yl]cyclobutanecarboxamide.

Molecular Properties

Compound NameN-[1-(4,6-dimethoxy-1,3,5-triazin-2-yl)piperidin-4-yl]cyclobutanecarboxamide
PubChem CID163357717
Molecular FormulaC15H23N5O3
Molecular Weight321.38 g/mol
Exact Mass321.18
IUPAC NameN-[1-(4,6-dimethoxy-1,3,5-triazin-2-yl)piperidin-4-yl]cyclobutanecarboxamide
SMILESCOc1nc(OC)nc(N2CCC(NC(=O)C3CCC3)CC2)n1
InChIInChI=1S/C15H23N5O3/c1-22-14-17-13(18-15(19-14)23-2)20-8-6-11(7-9-20)16-12(21)10-4-3-5-10/h10-11H,3-9H2,1-2H3,(H,16,21)
InChIKeyHPHYCUSTXRXSCI-UHFFFAOYSA-N
XLogP0.77
TPSA89.47 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.38
LogP ≤ 50.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze N-[1-(4,6-dimethoxy-1,3,5-triazin-2-yl)piperidin-4-yl]cyclobutanecarboxamide 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-[1-(4,6-dimethoxy-1,3,5-triazin-2-yl)piperidin-4-yl]cyclobutanecarboxamide?
The IUPAC name of N-[1-(4,6-dimethoxy-1,3,5-triazin-2-yl)piperidin-4-yl]cyclobutanecarboxamide (CID 163357717) is N-[1-(4,6-dimethoxy-1,3,5-triazin-2-yl)piperidin-4-yl]cyclobutanecarboxamide.
What is the SMILES notation for N-[1-(4,6-dimethoxy-1,3,5-triazin-2-yl)piperidin-4-yl]cyclobutanecarboxamide?
The canonical SMILES for N-[1-(4,6-dimethoxy-1,3,5-triazin-2-yl)piperidin-4-yl]cyclobutanecarboxamide is COc1nc(OC)nc(N2CCC(NC(=O)C3CCC3)CC2)n1.
What is the InChIKey of N-[1-(4,6-dimethoxy-1,3,5-triazin-2-yl)piperidin-4-yl]cyclobutanecarboxamide?
The InChIKey is HPHYCUSTXRXSCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N5O3/c1-22-14-17-13(18-15(19-14)23-2)20-8-6-11(7-9-20)16-12(21)10-4-3-5-10/h10-11H,3-9H2,1-2H3,(H,16,21).
What are the key properties of N-[1-(4,6-dimethoxy-1,3,5-triazin-2-yl)piperidin-4-yl]cyclobutanecarboxamide?
N-[1-(4,6-dimethoxy-1,3,5-triazin-2-yl)piperidin-4-yl]cyclobutanecarboxamide has a molecular weight of 321.38 g/mol, XLogP of 0.77, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4,6-dimethoxy-1,3,5-triazin-2-yl)piperidin-4-yl]cyclobutanecarboxamide is sourced from PubChem (CID 163357717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).