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

C22H19NO3 — CID 872269

IUPACN-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,2-diphenylacetamide
SMILESO=C(Nc1ccc2c(c1)OCCO2)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C22H19NO3/c24-22(23-18-11-12-19-20(15-18)26-14-13-25-19)21(16-7-3-1-4-8-16)17-9-5-2-6-10-17/h1-12,15,21H,13-14H2,(H,23,24)
InChIKeyDSXJMOVDODYWOY-UHFFFAOYSA-N
MW345.40 g/mol
LogP4.23
Rot. Bonds4

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

N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,2-diphenylacetamide (PubChem CID 872269) has the molecular formula C22H19NO3 and a molecular weight of 345.40 g/mol. Its IUPAC name is N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,2-diphenylacetamide.

Molecular Properties

Compound NameN-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,2-diphenylacetamide
PubChem CID872269
Molecular FormulaC22H19NO3
Molecular Weight345.40 g/mol
Exact Mass345.14
IUPAC NameN-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,2-diphenylacetamide
SMILESO=C(Nc1ccc2c(c1)OCCO2)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C22H19NO3/c24-22(23-18-11-12-19-20(15-18)26-14-13-25-19)21(16-7-3-1-4-8-16)17-9-5-2-6-10-17/h1-12,15,21H,13-14H2,(H,23,24)
InChIKeyDSXJMOVDODYWOY-UHFFFAOYSA-N
XLogP4.23
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.40
LogP ≤ 54.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methoxy-2-phenylacetamide
CID 1076352
(2S)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-phenylpentanamide
CID 51866041
N-(1,3-benzodioxol-5-yl)-2-[(2,2-diphenylacetyl)amino]benzamide
CID 2559897
(2S)-2-(dibenzylamino)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-phenylacetamide
CID 94233312
N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-2,2-diphenylacetamide
CID 2567069
(2R)-N-(1,3-benzodioxol-5-yl)-2-chloro-2-phenylacetamide
CID 93239229
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-phenylbutanamide
CID 2948413
(2S)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-phenyl-2-phenylsulfanylacetamide
CID 8896524
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(1,3-dioxoisoindol-2-yl)propanamide
CID 3119946
N-[(1R)-2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxo-1-phenylethyl]pyridine-2-carboxamide
CID 7044137
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-phenyl-2-(N-prop-2-enylanilino)acetamide
CID 4985969
2-(3-acetamidophenyl)sulfanyl-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-phenylacetamide
CID 18901216

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,2-diphenylacetamide?
The IUPAC name of N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,2-diphenylacetamide (CID 872269) is N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,2-diphenylacetamide.
What is the SMILES notation for N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,2-diphenylacetamide?
The canonical SMILES for N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,2-diphenylacetamide is O=C(Nc1ccc2c(c1)OCCO2)C(c1ccccc1)c1ccccc1.
What is the InChIKey of N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,2-diphenylacetamide?
The InChIKey is DSXJMOVDODYWOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19NO3/c24-22(23-18-11-12-19-20(15-18)26-14-13-25-19)21(16-7-3-1-4-8-16)17-9-5-2-6-10-17/h1-12,15,21H,13-14H2,(H,23,24).
What are the key properties of N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,2-diphenylacetamide?
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,2-diphenylacetamide has a molecular weight of 345.40 g/mol, XLogP of 4.23, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,2-diphenylacetamide is sourced from PubChem (CID 872269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).