N-(4-acetamidophenyl)-2-(2,3-dihydro-1-benzofuran-3-yl)acetamide

C18H18N2O3 — CID 110753843

IUPACN-(4-acetamidophenyl)-2-(2,3-dihydro-1-benzofuran-3-yl)acetamide
SMILESCC(=O)Nc1ccc(NC(=O)CC2COc3ccccc32)cc1
InChIInChI=1S/C18H18N2O3/c1-12(21)19-14-6-8-15(9-7-14)20-18(22)10-13-11-23-17-5-3-2-4-16(13)17/h2-9,13H,10-11H2,1H3,(H,19,21)(H,20,22)
InChIKeyMYURLGHCYBWKSA-UHFFFAOYSA-N
MW310.35 g/mol
LogP3.15
Rot. Bonds4

About N-(4-acetamidophenyl)-2-(2,3-dihydro-1-benzofuran-3-yl)acetamide

N-(4-acetamidophenyl)-2-(2,3-dihydro-1-benzofuran-3-yl)acetamide (PubChem CID 110753843) has the molecular formula C18H18N2O3 and a molecular weight of 310.35 g/mol. Its IUPAC name is N-(4-acetamidophenyl)-2-(2,3-dihydro-1-benzofuran-3-yl)acetamide.

Molecular Properties

Compound NameN-(4-acetamidophenyl)-2-(2,3-dihydro-1-benzofuran-3-yl)acetamide
PubChem CID110753843
Molecular FormulaC18H18N2O3
Molecular Weight310.35 g/mol
Exact Mass310.13
IUPAC NameN-(4-acetamidophenyl)-2-(2,3-dihydro-1-benzofuran-3-yl)acetamide
SMILESCC(=O)Nc1ccc(NC(=O)CC2COc3ccccc32)cc1
InChIInChI=1S/C18H18N2O3/c1-12(21)19-14-6-8-15(9-7-14)20-18(22)10-13-11-23-17-5-3-2-4-16(13)17/h2-9,13H,10-11H2,1H3,(H,19,21)(H,20,22)
InChIKeyMYURLGHCYBWKSA-UHFFFAOYSA-N
XLogP3.15
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.35
LogP ≤ 53.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2,3-dihydro-1-benzofuran-3-yl)-N-pyridin-2-ylacetamide
CID 110753861
N-[4-[(2,3-dihydro-1-benzofuran-3-ylamino)methyl]phenyl]acetamide
CID 63378630
2-(2,3-dihydro-1-benzofuran-3-yl)-N-(2-methoxy-5-methylphenyl)acetamide
CID 110753832
N-[3-[[2-[(4S)-3,4-dihydro-2H-chromen-4-yl]acetyl]amino]phenyl]propanamide
CID 95771072
2-(2,3-dihydro-1-benzofuran-3-yl)-N-[(2-methoxyphenyl)methyl]acetamide
CID 110753758
[2-(4-acetamidoanilino)-2-oxoethyl] (3R)-2,3-dihydro-1,4-benzodioxine-3-carboxylate
CID 2614981
2-(2,3-dihydro-1-benzofuran-3-yl)ethyl acetate
CID 15732877
N-[4-(3,4-dihydro-2H-chromen-4-ylcarbamoylamino)phenyl]acetamide
CID 110866526
N-(4-bromophenyl)-2-[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]acetamide
CID 845205
1-(azepan-1-yl)-2-(2,3-dihydro-1-benzofuran-3-yl)ethanone
CID 110753812
1-(3,4-dihydro-2H-chromen-4-yl)propan-2-one
CID 14203080
N-(4-fluorophenyl)-2-(4-methyl-2,3-dihydro-1,4-benzoxazin-3-yl)acetamide
CID 53013642

Frequently Asked Questions

What is the IUPAC name of N-(4-acetamidophenyl)-2-(2,3-dihydro-1-benzofuran-3-yl)acetamide?
The IUPAC name of N-(4-acetamidophenyl)-2-(2,3-dihydro-1-benzofuran-3-yl)acetamide (CID 110753843) is N-(4-acetamidophenyl)-2-(2,3-dihydro-1-benzofuran-3-yl)acetamide.
What is the SMILES notation for N-(4-acetamidophenyl)-2-(2,3-dihydro-1-benzofuran-3-yl)acetamide?
The canonical SMILES for N-(4-acetamidophenyl)-2-(2,3-dihydro-1-benzofuran-3-yl)acetamide is CC(=O)Nc1ccc(NC(=O)CC2COc3ccccc32)cc1.
What is the InChIKey of N-(4-acetamidophenyl)-2-(2,3-dihydro-1-benzofuran-3-yl)acetamide?
The InChIKey is MYURLGHCYBWKSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O3/c1-12(21)19-14-6-8-15(9-7-14)20-18(22)10-13-11-23-17-5-3-2-4-16(13)17/h2-9,13H,10-11H2,1H3,(H,19,21)(H,20,22).
What are the key properties of N-(4-acetamidophenyl)-2-(2,3-dihydro-1-benzofuran-3-yl)acetamide?
N-(4-acetamidophenyl)-2-(2,3-dihydro-1-benzofuran-3-yl)acetamide has a molecular weight of 310.35 g/mol, XLogP of 3.15, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetamidophenyl)-2-(2,3-dihydro-1-benzofuran-3-yl)acetamide is sourced from PubChem (CID 110753843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).