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

C14H23N5O4 — CID 3222667

IUPAC1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-N-(2-methoxyethyl)piperidine-4-carboxamide
SMILESCOCCNC(=O)C1CCN(c2nc(OC)nc(OC)n2)CC1
InChIInChI=1S/C14H23N5O4/c1-21-9-6-15-11(20)10-4-7-19(8-5-10)12-16-13(22-2)18-14(17-12)23-3/h10H,4-9H2,1-3H3,(H,15,20)
InChIKeyPRMSJWDOUIFICD-UHFFFAOYSA-N
MW325.37 g/mol
LogP-0.13
Rot. Bonds7

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

1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-N-(2-methoxyethyl)piperidine-4-carboxamide (PubChem CID 3222667) has the molecular formula C14H23N5O4 and a molecular weight of 325.37 g/mol. Its IUPAC name is 1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-N-(2-methoxyethyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-N-(2-methoxyethyl)piperidine-4-carboxamide
PubChem CID3222667
Molecular FormulaC14H23N5O4
Molecular Weight325.37 g/mol
Exact Mass325.18
IUPAC Name1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-N-(2-methoxyethyl)piperidine-4-carboxamide
SMILESCOCCNC(=O)C1CCN(c2nc(OC)nc(OC)n2)CC1
InChIInChI=1S/C14H23N5O4/c1-21-9-6-15-11(20)10-4-7-19(8-5-10)12-16-13(22-2)18-14(17-12)23-3/h10H,4-9H2,1-3H3,(H,15,20)
InChIKeyPRMSJWDOUIFICD-UHFFFAOYSA-N
XLogP-0.13
TPSA98.70 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.37
LogP ≤ 5-0.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-N-(2-methoxyethyl)piperidine-4-carboxamide?
The IUPAC name of 1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-N-(2-methoxyethyl)piperidine-4-carboxamide (CID 3222667) is 1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-N-(2-methoxyethyl)piperidine-4-carboxamide.
What is the SMILES notation for 1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-N-(2-methoxyethyl)piperidine-4-carboxamide?
The canonical SMILES for 1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-N-(2-methoxyethyl)piperidine-4-carboxamide is COCCNC(=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-methoxyethyl)piperidine-4-carboxamide?
The InChIKey is PRMSJWDOUIFICD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N5O4/c1-21-9-6-15-11(20)10-4-7-19(8-5-10)12-16-13(22-2)18-14(17-12)23-3/h10H,4-9H2,1-3H3,(H,15,20).
What are the key properties of 1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-N-(2-methoxyethyl)piperidine-4-carboxamide?
1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-N-(2-methoxyethyl)piperidine-4-carboxamide has a molecular weight of 325.37 g/mol, XLogP of -0.13, 7 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-N-(2-methoxyethyl)piperidine-4-carboxamide is sourced from PubChem (CID 3222667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).