2-N,6-N-dimethyl-1,2,3,6-tetrahydropyridine-2,6-dicarboxamide

C9H15N3O2 — CID 149041190

IUPAC2-N,6-N-dimethyl-1,2,3,6-tetrahydropyridine-2,6-dicarboxamide
SMILESCNC(=O)C1C=CCC(C(=O)NC)N1
InChIInChI=1S/C9H15N3O2/c1-10-8(13)6-4-3-5-7(12-6)9(14)11-2/h3-4,6-7,12H,5H2,1-2H3,(H,10,13)(H,11,14)
InChIKeyQHPQCILBISYLBE-UHFFFAOYSA-N
MW197.24 g/mol
LogP-1.23
Rot. Bonds2

About 2-N,6-N-dimethyl-1,2,3,6-tetrahydropyridine-2,6-dicarboxamide

2-N,6-N-dimethyl-1,2,3,6-tetrahydropyridine-2,6-dicarboxamide (PubChem CID 149041190) has the molecular formula C9H15N3O2 and a molecular weight of 197.24 g/mol. Its IUPAC name is 2-N,6-N-dimethyl-1,2,3,6-tetrahydropyridine-2,6-dicarboxamide.

Molecular Properties

Compound Name2-N,6-N-dimethyl-1,2,3,6-tetrahydropyridine-2,6-dicarboxamide
PubChem CID149041190
Molecular FormulaC9H15N3O2
Molecular Weight197.24 g/mol
Exact Mass197.12
IUPAC Name2-N,6-N-dimethyl-1,2,3,6-tetrahydropyridine-2,6-dicarboxamide
SMILESCNC(=O)C1C=CCC(C(=O)NC)N1
InChIInChI=1S/C9H15N3O2/c1-10-8(13)6-4-3-5-7(12-6)9(14)11-2/h3-4,6-7,12H,5H2,1-2H3,(H,10,13)(H,11,14)
InChIKeyQHPQCILBISYLBE-UHFFFAOYSA-N
XLogP-1.23
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.24
LogP ≤ 5-1.23
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

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2-(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)-N-methylpropanamide
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Frequently Asked Questions

What is the IUPAC name of 2-N,6-N-dimethyl-1,2,3,6-tetrahydropyridine-2,6-dicarboxamide?
The IUPAC name of 2-N,6-N-dimethyl-1,2,3,6-tetrahydropyridine-2,6-dicarboxamide (CID 149041190) is 2-N,6-N-dimethyl-1,2,3,6-tetrahydropyridine-2,6-dicarboxamide.
What is the SMILES notation for 2-N,6-N-dimethyl-1,2,3,6-tetrahydropyridine-2,6-dicarboxamide?
The canonical SMILES for 2-N,6-N-dimethyl-1,2,3,6-tetrahydropyridine-2,6-dicarboxamide is CNC(=O)C1C=CCC(C(=O)NC)N1.
What is the InChIKey of 2-N,6-N-dimethyl-1,2,3,6-tetrahydropyridine-2,6-dicarboxamide?
The InChIKey is QHPQCILBISYLBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O2/c1-10-8(13)6-4-3-5-7(12-6)9(14)11-2/h3-4,6-7,12H,5H2,1-2H3,(H,10,13)(H,11,14).
What are the key properties of 2-N,6-N-dimethyl-1,2,3,6-tetrahydropyridine-2,6-dicarboxamide?
2-N,6-N-dimethyl-1,2,3,6-tetrahydropyridine-2,6-dicarboxamide has a molecular weight of 197.24 g/mol, XLogP of -1.23, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,6-N-dimethyl-1,2,3,6-tetrahydropyridine-2,6-dicarboxamide is sourced from PubChem (CID 149041190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).