N-[1-[6-[2-(4-propoxyphenyl)ethyl]-1-benzofuran-2-yl]ethyl]acetamide

C23H27NO3 — CID 58047216

IUPACN-[1-[6-[2-(4-propoxyphenyl)ethyl]-1-benzofuran-2-yl]ethyl]acetamide
SMILESCCCOc1ccc(CCc2ccc3cc(C(C)NC(C)=O)oc3c2)cc1
InChIInChI=1S/C23H27NO3/c1-4-13-26-21-11-8-18(9-12-21)5-6-19-7-10-20-15-22(27-23(20)14-19)16(2)24-17(3)25/h7-12,14-16H,4-6,13H2,1-3H3,(H,24,25)
InChIKeyNBMCMDDSZIVKLG-UHFFFAOYSA-N
MW365.47 g/mol
LogP5.20
Rot. Bonds8

About N-[1-[6-[2-(4-propoxyphenyl)ethyl]-1-benzofuran-2-yl]ethyl]acetamide

N-[1-[6-[2-(4-propoxyphenyl)ethyl]-1-benzofuran-2-yl]ethyl]acetamide (PubChem CID 58047216) has the molecular formula C23H27NO3 and a molecular weight of 365.47 g/mol. Its IUPAC name is N-[1-[6-[2-(4-propoxyphenyl)ethyl]-1-benzofuran-2-yl]ethyl]acetamide.

Molecular Properties

Compound NameN-[1-[6-[2-(4-propoxyphenyl)ethyl]-1-benzofuran-2-yl]ethyl]acetamide
PubChem CID58047216
Molecular FormulaC23H27NO3
Molecular Weight365.47 g/mol
Exact Mass365.20
IUPAC NameN-[1-[6-[2-(4-propoxyphenyl)ethyl]-1-benzofuran-2-yl]ethyl]acetamide
SMILESCCCOc1ccc(CCc2ccc3cc(C(C)NC(C)=O)oc3c2)cc1
InChIInChI=1S/C23H27NO3/c1-4-13-26-21-11-8-18(9-12-21)5-6-19-7-10-20-15-22(27-23(20)14-19)16(2)24-17(3)25/h7-12,14-16H,4-6,13H2,1-3H3,(H,24,25)
InChIKeyNBMCMDDSZIVKLG-UHFFFAOYSA-N
XLogP5.20
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500365.47
LogP ≤ 55.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[1-[6-[2-(4-propoxyphenyl)ethyl]-1-benzofuran-2-yl]ethyl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

ethyl 3-oxo-3-[1-[6-[2-(4-propoxyphenyl)ethyl]-1-benzofuran-2-yl]ethylamino]propanoate
CID 58047317
N-[1-[6-[2-(4-hydroxyphenyl)ethyl]-1-benzofuran-2-yl]ethyl]acetamide
CID 58047041
1-[6-[2-(4-ethoxyphenyl)ethyl]-1-benzofuran-2-yl]-N-methylethanamine
CID 143982625
N-[1-[5-[2-(4-hydroxyphenyl)ethyl]-1-benzofuran-2-yl]ethyl]acetamide
CID 58047066
tert-butyl-[1-[6-[(4-propoxyphenoxy)methyl]-1-benzofuran-2-yl]ethyl]carbamic acid
CID 67015773
N-[2-[[(1R)-1-(1-benzofuran-2-yl)ethyl]amino]-2-oxoethyl]-4-butoxybenzamide
CID 9366881
N-[(1R)-1-(1-benzofuran-2-yl)ethyl]-2-(4-methoxyphenyl)acetamide
CID 9366106
N-[(1R)-1-(1-benzofuran-2-yl)ethyl]-2-(2-formyl-5-propoxyphenoxy)acetamide
CID 9017734
N-[1-(1-benzofuran-2-yl)ethyl]-2-[(4-ethoxyphenyl)methyl-methylamino]acetamide
CID 18087446
N-[2-[(4-propoxybenzoyl)amino]ethyl]-1-benzofuran-2-carboxamide
CID 71480810
N-[1-[5-[(4-ethoxy-2-fluorophenyl)methoxy]-1-benzofuran-2-yl]ethyl]acetamide
CID 58047453
N-(4-butylphenyl)-2-oxo-7-propoxychromene-3-carboxamide
CID 5263305

Frequently Asked Questions

What is the IUPAC name of N-[1-[6-[2-(4-propoxyphenyl)ethyl]-1-benzofuran-2-yl]ethyl]acetamide?
The IUPAC name of N-[1-[6-[2-(4-propoxyphenyl)ethyl]-1-benzofuran-2-yl]ethyl]acetamide (CID 58047216) is N-[1-[6-[2-(4-propoxyphenyl)ethyl]-1-benzofuran-2-yl]ethyl]acetamide.
What is the SMILES notation for N-[1-[6-[2-(4-propoxyphenyl)ethyl]-1-benzofuran-2-yl]ethyl]acetamide?
The canonical SMILES for N-[1-[6-[2-(4-propoxyphenyl)ethyl]-1-benzofuran-2-yl]ethyl]acetamide is CCCOc1ccc(CCc2ccc3cc(C(C)NC(C)=O)oc3c2)cc1.
What is the InChIKey of N-[1-[6-[2-(4-propoxyphenyl)ethyl]-1-benzofuran-2-yl]ethyl]acetamide?
The InChIKey is NBMCMDDSZIVKLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H27NO3/c1-4-13-26-21-11-8-18(9-12-21)5-6-19-7-10-20-15-22(27-23(20)14-19)16(2)24-17(3)25/h7-12,14-16H,4-6,13H2,1-3H3,(H,24,25).
What are the key properties of N-[1-[6-[2-(4-propoxyphenyl)ethyl]-1-benzofuran-2-yl]ethyl]acetamide?
N-[1-[6-[2-(4-propoxyphenyl)ethyl]-1-benzofuran-2-yl]ethyl]acetamide has a molecular weight of 365.47 g/mol, XLogP of 5.20, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[6-[2-(4-propoxyphenyl)ethyl]-1-benzofuran-2-yl]ethyl]acetamide is sourced from PubChem (CID 58047216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).