N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-methylpyridine-3-carboxamide

C15H14N2O3 — CID 110752821

IUPACN-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-methylpyridine-3-carboxamide
SMILESCN(C(=O)c1cccnc1)c1ccc2c(c1)OCCO2
InChIInChI=1S/C15H14N2O3/c1-17(15(18)11-3-2-6-16-10-11)12-4-5-13-14(9-12)20-8-7-19-13/h2-6,9-10H,7-8H2,1H3
InChIKeyQWSCIVYYPPVAAZ-UHFFFAOYSA-N
MW270.29 g/mol
LogP2.13
Rot. Bonds2

About N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-methylpyridine-3-carboxamide

N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-methylpyridine-3-carboxamide (PubChem CID 110752821) has the molecular formula C15H14N2O3 and a molecular weight of 270.29 g/mol. Its IUPAC name is N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-methylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-methylpyridine-3-carboxamide
PubChem CID110752821
Molecular FormulaC15H14N2O3
Molecular Weight270.29 g/mol
Exact Mass270.10
IUPAC NameN-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-methylpyridine-3-carboxamide
SMILESCN(C(=O)c1cccnc1)c1ccc2c(c1)OCCO2
InChIInChI=1S/C15H14N2O3/c1-17(15(18)11-3-2-6-16-10-11)12-4-5-13-14(9-12)20-8-7-19-13/h2-6,9-10H,7-8H2,1H3
InChIKeyQWSCIVYYPPVAAZ-UHFFFAOYSA-N
XLogP2.13
TPSA51.66 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.29
LogP ≤ 52.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-N-phenylpyridine-3-carboxamide;hydrochloride
CID 110756365
N-(1,3-benzodioxol-5-yl)-N-methylpyrazine-2-carboxamide
CID 110752252
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-methylacetamide
CID 110752776
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N,2-dimethylbenzamide
CID 110752792
N-methyl-N-(4-sulfamoylphenyl)pyridine-3-carboxamide
CID 61129416
3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-pyridin-3-ylprop-2-en-1-one
CID 3581369
N-[[1-(2,3-dihydro-1,4-benzodioxin-6-yl)cyclopropyl]methyl]pyridine-3-carboxamide
CID 113090819
2-[4-[methyl(pyridine-3-carbonyl)amino]phenyl]acetic acid;hydrochloride
CID 52988212
N-[(E)-2,3-dihydro-1,4-benzodioxin-6-ylmethylideneamino]pyridine-3-carboxamide
CID 6898640
N-[6-(cyclopropylamino)-3-pyridinyl]-N-methylpyridine-3-carboxamide
CID 115268669
2,3-dihydro-1,4-benzodioxin-6-yl-[4-(pyridine-3-carbonyl)-1,4-diazepan-1-yl]methanone
CID 110808457
N,N-dimethylpyridine-3-carboxamide;ethane
CID 142562125

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-methylpyridine-3-carboxamide?
The IUPAC name of N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-methylpyridine-3-carboxamide (CID 110752821) is N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-methylpyridine-3-carboxamide.
What is the SMILES notation for N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-methylpyridine-3-carboxamide?
The canonical SMILES for N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-methylpyridine-3-carboxamide is CN(C(=O)c1cccnc1)c1ccc2c(c1)OCCO2.
What is the InChIKey of N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-methylpyridine-3-carboxamide?
The InChIKey is QWSCIVYYPPVAAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O3/c1-17(15(18)11-3-2-6-16-10-11)12-4-5-13-14(9-12)20-8-7-19-13/h2-6,9-10H,7-8H2,1H3.
What are the key properties of N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-methylpyridine-3-carboxamide?
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-methylpyridine-3-carboxamide has a molecular weight of 270.29 g/mol, XLogP of 2.13, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-methylpyridine-3-carboxamide is sourced from PubChem (CID 110752821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).