6-N-cyclopropyl-2-N-(2,3-dihydro-1,4-benzodioxin-6-yl)pyridine-2,6-dicarboxamide

C18H17N3O4 — CID 109093973

IUPAC6-N-cyclopropyl-2-N-(2,3-dihydro-1,4-benzodioxin-6-yl)pyridine-2,6-dicarboxamide
SMILESO=C(Nc1ccc2c(c1)OCCO2)c1cccc(C(=O)NC2CC2)n1
InChIInChI=1S/C18H17N3O4/c22-17(19-11-4-5-11)13-2-1-3-14(21-13)18(23)20-12-6-7-15-16(10-12)25-9-8-24-15/h1-3,6-7,10-11H,4-5,8-9H2,(H,19,22)(H,20,23)
InChIKeyLOEFAFLSMYXZIS-UHFFFAOYSA-N
MW339.35 g/mol
LogP2.00
Rot. Bonds4

About 6-N-cyclopropyl-2-N-(2,3-dihydro-1,4-benzodioxin-6-yl)pyridine-2,6-dicarboxamide

6-N-cyclopropyl-2-N-(2,3-dihydro-1,4-benzodioxin-6-yl)pyridine-2,6-dicarboxamide (PubChem CID 109093973) has the molecular formula C18H17N3O4 and a molecular weight of 339.35 g/mol. Its IUPAC name is 6-N-cyclopropyl-2-N-(2,3-dihydro-1,4-benzodioxin-6-yl)pyridine-2,6-dicarboxamide.

Molecular Properties

Compound Name6-N-cyclopropyl-2-N-(2,3-dihydro-1,4-benzodioxin-6-yl)pyridine-2,6-dicarboxamide
PubChem CID109093973
Molecular FormulaC18H17N3O4
Molecular Weight339.35 g/mol
Exact Mass339.12
IUPAC Name6-N-cyclopropyl-2-N-(2,3-dihydro-1,4-benzodioxin-6-yl)pyridine-2,6-dicarboxamide
SMILESO=C(Nc1ccc2c(c1)OCCO2)c1cccc(C(=O)NC2CC2)n1
InChIInChI=1S/C18H17N3O4/c22-17(19-11-4-5-11)13-2-1-3-14(21-13)18(23)20-12-6-7-15-16(10-12)25-9-8-24-15/h1-3,6-7,10-11H,4-5,8-9H2,(H,19,22)(H,20,23)
InChIKeyLOEFAFLSMYXZIS-UHFFFAOYSA-N
XLogP2.00
TPSA89.55 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.35
LogP ≤ 52.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 6-N-cyclopropyl-2-N-(2,3-dihydro-1,4-benzodioxin-6-yl)pyridine-2,6-dicarboxamide with MolForge

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Related Compounds

6-N-cyclopropyl-2-N-[4-(dimethylamino)phenyl]pyridine-2,6-dicarboxamide
CID 109093956
1-N-cycloheptyl-4-N-(2,3-dihydro-1,4-benzodioxin-6-yl)benzene-1,4-dicarboxamide
CID 109048581
2-N-(3-chlorophenyl)-6-N-cyclopentylpyridine-2,6-dicarboxamide
CID 109095035
2-N-(1,3-benzodioxol-5-yl)-6-N-(3,4-difluorophenyl)pyridine-2,6-dicarboxamide
CID 109101072
2-N-(1,3-benzodioxol-5-yl)-6-N-(2,6-difluorophenyl)pyridine-2,6-dicarboxamide
CID 109101071
N'-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[4-(pyridine-2-carbonylamino)phenyl]oxamide
CID 3220639
2,6-dichloro-N-(2,3-dihydro-1,4-benzodioxin-6-yl)benzamide
CID 777312
2-N-(1,3-benzodioxol-5-yl)-6-N-(2-chlorophenyl)pyridine-2,6-dicarboxamide
CID 109100819
N-(1,3-benzodioxol-5-yl)-6-(4-methylpiperidine-1-carbonyl)pyridine-2-carboxamide
CID 109095533
6-N-cyclopentyl-2-N-(4-fluorophenyl)pyridine-2,6-dicarboxamide
CID 109095033
2-N-cycloheptyl-6-N-cyclopropylpyridine-2,6-dicarboxamide
CID 109093881
2-N-(3-acetylphenyl)-6-N-cyclohexylpyridine-2,6-dicarboxamide
CID 109095376

Frequently Asked Questions

What is the IUPAC name of 6-N-cyclopropyl-2-N-(2,3-dihydro-1,4-benzodioxin-6-yl)pyridine-2,6-dicarboxamide?
The IUPAC name of 6-N-cyclopropyl-2-N-(2,3-dihydro-1,4-benzodioxin-6-yl)pyridine-2,6-dicarboxamide (CID 109093973) is 6-N-cyclopropyl-2-N-(2,3-dihydro-1,4-benzodioxin-6-yl)pyridine-2,6-dicarboxamide.
What is the SMILES notation for 6-N-cyclopropyl-2-N-(2,3-dihydro-1,4-benzodioxin-6-yl)pyridine-2,6-dicarboxamide?
The canonical SMILES for 6-N-cyclopropyl-2-N-(2,3-dihydro-1,4-benzodioxin-6-yl)pyridine-2,6-dicarboxamide is O=C(Nc1ccc2c(c1)OCCO2)c1cccc(C(=O)NC2CC2)n1.
What is the InChIKey of 6-N-cyclopropyl-2-N-(2,3-dihydro-1,4-benzodioxin-6-yl)pyridine-2,6-dicarboxamide?
The InChIKey is LOEFAFLSMYXZIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3O4/c22-17(19-11-4-5-11)13-2-1-3-14(21-13)18(23)20-12-6-7-15-16(10-12)25-9-8-24-15/h1-3,6-7,10-11H,4-5,8-9H2,(H,19,22)(H,20,23).
What are the key properties of 6-N-cyclopropyl-2-N-(2,3-dihydro-1,4-benzodioxin-6-yl)pyridine-2,6-dicarboxamide?
6-N-cyclopropyl-2-N-(2,3-dihydro-1,4-benzodioxin-6-yl)pyridine-2,6-dicarboxamide has a molecular weight of 339.35 g/mol, XLogP of 2.00, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-cyclopropyl-2-N-(2,3-dihydro-1,4-benzodioxin-6-yl)pyridine-2,6-dicarboxamide is sourced from PubChem (CID 109093973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).