N-(2-methoxydibenzofuran-3-yl)-3,3-diphenylpropanamide

C28H23NO3 — CID 2935191

IUPACN-(2-methoxydibenzofuran-3-yl)-3,3-diphenylpropanamide
SMILESCOc1cc2c(cc1NC(=O)CC(c1ccccc1)c1ccccc1)oc1ccccc12
InChIInChI=1S/C28H23NO3/c1-31-27-16-23-21-14-8-9-15-25(21)32-26(23)18-24(27)29-28(30)17-22(19-10-4-2-5-11-19)20-12-6-3-7-13-20/h2-16,18,22H,17H2,1H3,(H,29,30)
InChIKeyGVGHDLQZQUFVIJ-UHFFFAOYSA-N
MW421.50 g/mol
LogP6.76
Rot. Bonds6

About N-(2-methoxydibenzofuran-3-yl)-3,3-diphenylpropanamide

N-(2-methoxydibenzofuran-3-yl)-3,3-diphenylpropanamide (PubChem CID 2935191) has the molecular formula C28H23NO3 and a molecular weight of 421.50 g/mol. Its IUPAC name is N-(2-methoxydibenzofuran-3-yl)-3,3-diphenylpropanamide.

Molecular Properties

Compound NameN-(2-methoxydibenzofuran-3-yl)-3,3-diphenylpropanamide
PubChem CID2935191
Molecular FormulaC28H23NO3
Molecular Weight421.50 g/mol
Exact Mass421.17
IUPAC NameN-(2-methoxydibenzofuran-3-yl)-3,3-diphenylpropanamide
SMILESCOc1cc2c(cc1NC(=O)CC(c1ccccc1)c1ccccc1)oc1ccccc12
InChIInChI=1S/C28H23NO3/c1-31-27-16-23-21-14-8-9-15-25(21)32-26(23)18-24(27)29-28(30)17-22(19-10-4-2-5-11-19)20-12-6-3-7-13-20/h2-16,18,22H,17H2,1H3,(H,29,30)
InChIKeyGVGHDLQZQUFVIJ-UHFFFAOYSA-N
XLogP6.76
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500421.50
LogP ≤ 56.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[2-[(2-methoxydibenzofuran-3-yl)amino]-2-oxoethyl]-[(1R)-1-phenylethyl]azanium
CID 2684318
[2-[(2-methoxydibenzofuran-3-yl)amino]-2-oxoethyl] 2-hydroxy-2-phenylacetate
CID 23911923
2-[2-[(2-methoxydibenzofuran-3-yl)amino]-2-oxoethyl]sulfanylacetic acid
CID 2401504
1-(2-hydroxy-1-phenylethyl)-3-(2-methoxydibenzofuran-3-yl)urea
CID 72686859
2-[[2-[(2-methoxydibenzofuran-3-yl)amino]-2-oxoethyl]-methylamino]-N-methylacetamide
CID 78826575
3-[[2-[(2-methoxydibenzofuran-3-yl)amino]-2-oxoethyl]-methylamino]-2-methylpropanoic acid
CID 122120326
1-ethyl-3-(2-methoxydibenzofuran-3-yl)urea
CID 86976519
N-(2-methoxydibenzofuran-3-yl)-2-methyl-3-(methylamino)propanamide;hydrochloride
CID 119674201
3-(carbamoylamino)-N-(2-methoxydibenzofuran-3-yl)-3-thiophen-2-ylpropanamide
CID 134042571
[2-[(2-methoxydibenzofuran-3-yl)amino]-2-oxoethyl] cyclopropanecarboxylate
CID 2510908
N-(2-methoxydibenzofuran-3-yl)-2-(2,2,2-trifluoroethoxy)acetamide
CID 55488412
N-(2-methoxydibenzofuran-3-yl)-2-piperidin-1-ylacetamide
CID 2697422

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxydibenzofuran-3-yl)-3,3-diphenylpropanamide?
The IUPAC name of N-(2-methoxydibenzofuran-3-yl)-3,3-diphenylpropanamide (CID 2935191) is N-(2-methoxydibenzofuran-3-yl)-3,3-diphenylpropanamide.
What is the SMILES notation for N-(2-methoxydibenzofuran-3-yl)-3,3-diphenylpropanamide?
The canonical SMILES for N-(2-methoxydibenzofuran-3-yl)-3,3-diphenylpropanamide is COc1cc2c(cc1NC(=O)CC(c1ccccc1)c1ccccc1)oc1ccccc12.
What is the InChIKey of N-(2-methoxydibenzofuran-3-yl)-3,3-diphenylpropanamide?
The InChIKey is GVGHDLQZQUFVIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H23NO3/c1-31-27-16-23-21-14-8-9-15-25(21)32-26(23)18-24(27)29-28(30)17-22(19-10-4-2-5-11-19)20-12-6-3-7-13-20/h2-16,18,22H,17H2,1H3,(H,29,30).
What are the key properties of N-(2-methoxydibenzofuran-3-yl)-3,3-diphenylpropanamide?
N-(2-methoxydibenzofuran-3-yl)-3,3-diphenylpropanamide has a molecular weight of 421.50 g/mol, XLogP of 6.76, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxydibenzofuran-3-yl)-3,3-diphenylpropanamide is sourced from PubChem (CID 2935191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).