N-(4-acetylphenyl)-3-(2,3-dihydro-1-benzofuran-5-yl)propanamide

C19H19NO3 — CID 53352123

IUPACN-(4-acetylphenyl)-3-(2,3-dihydro-1-benzofuran-5-yl)propanamide
SMILESCC(=O)c1ccc(NC(=O)CCc2ccc3c(c2)CCO3)cc1
InChIInChI=1S/C19H19NO3/c1-13(21)15-4-6-17(7-5-15)20-19(22)9-3-14-2-8-18-16(12-14)10-11-23-18/h2,4-8,12H,3,9-11H2,1H3,(H,20,22)
InChIKeyDPHVBBBGFLAPPF-UHFFFAOYSA-N
MW309.37 g/mol
LogP3.40
Rot. Bonds5

About N-(4-acetylphenyl)-3-(2,3-dihydro-1-benzofuran-5-yl)propanamide

N-(4-acetylphenyl)-3-(2,3-dihydro-1-benzofuran-5-yl)propanamide (PubChem CID 53352123) has the molecular formula C19H19NO3 and a molecular weight of 309.37 g/mol. Its IUPAC name is N-(4-acetylphenyl)-3-(2,3-dihydro-1-benzofuran-5-yl)propanamide.

Molecular Properties

Compound NameN-(4-acetylphenyl)-3-(2,3-dihydro-1-benzofuran-5-yl)propanamide
PubChem CID53352123
Molecular FormulaC19H19NO3
Molecular Weight309.37 g/mol
Exact Mass309.14
IUPAC NameN-(4-acetylphenyl)-3-(2,3-dihydro-1-benzofuran-5-yl)propanamide
SMILESCC(=O)c1ccc(NC(=O)CCc2ccc3c(c2)CCO3)cc1
InChIInChI=1S/C19H19NO3/c1-13(21)15-4-6-17(7-5-15)20-19(22)9-3-14-2-8-18-16(12-14)10-11-23-18/h2,4-8,12H,3,9-11H2,1H3,(H,20,22)
InChIKeyDPHVBBBGFLAPPF-UHFFFAOYSA-N
XLogP3.40
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.37
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,3-dihydro-1-benzofuran-5-yl)-3-naphthalen-2-ylpropanamide
CID 112844361
N-(2,3-dihydro-1-benzofuran-5-yl)-3-(3-fluorophenyl)propanamide
CID 34433022
1-(2,3-dihydro-1-benzofuran-5-yl)-5-methylhex-4-en-3-one
CID 103455479
N-(2,4-dichlorophenyl)-3-(2,3-dihydro-1-benzofuran-5-yl)propanamide
CID 5055071
2-(2,3-dihydro-1-benzofuran-5-yl)-N-(4-methylsulfonylphenyl)acetamide
CID 51311006
N-(4-acetylphenyl)-2-(4-oxo-3,5-dihydro-2H-1,5-benzoxazepin-7-yl)acetamide
CID 110770796
3-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(4-iodophenyl)propanamide
CID 17488745
5-bromo-N-(2,3-dihydro-1-benzofuran-5-yl)pentanamide
CID 107909036
N-[4-(cyanomethyl)phenyl]-2-(2,3-dihydro-1-benzofuran-5-yl)acetamide
CID 134012127
N-[4-(2-bromoethyl)phenyl]-2,3-dihydro-1-benzofuran-5-carboxamide
CID 114310163
1-(2,3-dihydro-1-benzofuran-5-yl)-4-(dimethylamino)-4-methylpentan-3-one
CID 79047128
N-[4-(aminomethyl)phenyl]-2,3-dihydro-1-benzofuran-5-carboxamide
CID 62198465

Frequently Asked Questions

What is the IUPAC name of N-(4-acetylphenyl)-3-(2,3-dihydro-1-benzofuran-5-yl)propanamide?
The IUPAC name of N-(4-acetylphenyl)-3-(2,3-dihydro-1-benzofuran-5-yl)propanamide (CID 53352123) is N-(4-acetylphenyl)-3-(2,3-dihydro-1-benzofuran-5-yl)propanamide.
What is the SMILES notation for N-(4-acetylphenyl)-3-(2,3-dihydro-1-benzofuran-5-yl)propanamide?
The canonical SMILES for N-(4-acetylphenyl)-3-(2,3-dihydro-1-benzofuran-5-yl)propanamide is CC(=O)c1ccc(NC(=O)CCc2ccc3c(c2)CCO3)cc1.
What is the InChIKey of N-(4-acetylphenyl)-3-(2,3-dihydro-1-benzofuran-5-yl)propanamide?
The InChIKey is DPHVBBBGFLAPPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19NO3/c1-13(21)15-4-6-17(7-5-15)20-19(22)9-3-14-2-8-18-16(12-14)10-11-23-18/h2,4-8,12H,3,9-11H2,1H3,(H,20,22).
What are the key properties of N-(4-acetylphenyl)-3-(2,3-dihydro-1-benzofuran-5-yl)propanamide?
N-(4-acetylphenyl)-3-(2,3-dihydro-1-benzofuran-5-yl)propanamide has a molecular weight of 309.37 g/mol, XLogP of 3.40, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetylphenyl)-3-(2,3-dihydro-1-benzofuran-5-yl)propanamide is sourced from PubChem (CID 53352123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).