2-(6-methoxy-1-benzofuran-3-yl)-N-(1-phenylcyclobutyl)acetamide

C21H21NO3 — CID 55462664

IUPAC2-(6-methoxy-1-benzofuran-3-yl)-N-(1-phenylcyclobutyl)acetamide
SMILESCOc1ccc2c(CC(=O)NC3(c4ccccc4)CCC3)coc2c1
InChIInChI=1S/C21H21NO3/c1-24-17-8-9-18-15(14-25-19(18)13-17)12-20(23)22-21(10-5-11-21)16-6-3-2-4-7-16/h2-4,6-9,13-14H,5,10-12H2,1H3,(H,22,23)
InChIKeyIZFOOZFAXDETKM-UHFFFAOYSA-N
MW335.40 g/mol
LogP4.18
Rot. Bonds5

About 2-(6-methoxy-1-benzofuran-3-yl)-N-(1-phenylcyclobutyl)acetamide

2-(6-methoxy-1-benzofuran-3-yl)-N-(1-phenylcyclobutyl)acetamide (PubChem CID 55462664) has the molecular formula C21H21NO3 and a molecular weight of 335.40 g/mol. Its IUPAC name is 2-(6-methoxy-1-benzofuran-3-yl)-N-(1-phenylcyclobutyl)acetamide.

Molecular Properties

Compound Name2-(6-methoxy-1-benzofuran-3-yl)-N-(1-phenylcyclobutyl)acetamide
PubChem CID55462664
Molecular FormulaC21H21NO3
Molecular Weight335.40 g/mol
Exact Mass335.15
IUPAC Name2-(6-methoxy-1-benzofuran-3-yl)-N-(1-phenylcyclobutyl)acetamide
SMILESCOc1ccc2c(CC(=O)NC3(c4ccccc4)CCC3)coc2c1
InChIInChI=1S/C21H21NO3/c1-24-17-8-9-18-15(14-25-19(18)13-17)12-20(23)22-21(10-5-11-21)16-6-3-2-4-7-16/h2-4,6-9,13-14H,5,10-12H2,1H3,(H,22,23)
InChIKeyIZFOOZFAXDETKM-UHFFFAOYSA-N
XLogP4.18
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.40
LogP ≤ 54.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-benzyl-2-(6-methoxy-1-benzofuran-3-yl)acetamide
CID 2598100
N-cycloheptyl-2-(6-methoxy-1-benzofuran-3-yl)acetamide
CID 2477196
2-(6-methoxy-1-benzofuran-3-yl)-N-[2-oxo-2-(propan-2-ylamino)ethyl]acetamide
CID 27742710
2-(6-methoxy-1-benzofuran-3-yl)-N-(2-methoxyethyl)acetamide
CID 29290752
N-[2-(ethylaminomethyl)phenyl]-2-(6-methoxy-1-benzofuran-3-yl)acetamide;hydrochloride
CID 119439857
2-(6-methoxy-1-benzofuran-3-yl)-N-(2-pyrrolidin-1-ylphenyl)acetamide
CID 8011717
(2R)-2-[[2-(6-methoxy-1-benzofuran-3-yl)acetyl]amino]propanamide
CID 92542869
N-[(1S)-1-(furan-2-yl)ethyl]-2-(6-methoxy-1-benzofuran-3-yl)acetamide
CID 40790081
cis-(1S,3R)-3-[[2-(6-methoxy-1-benzofuran-3-yl)acetyl]amino]cyclopentane-1-carboxylic acid
CID 120677153
N-[(2S)-1-aminopropan-2-yl]-2-(6-methoxy-1-benzofuran-3-yl)acetamide;hydrochloride
CID 120505622
benzyl 2-(6-methoxy-1-benzofuran-3-yl)acetate
CID 8961126
N-(1-benzothiophen-3-ylmethyl)-2-(6-methoxy-1-benzofuran-3-yl)acetamide
CID 55747538

Frequently Asked Questions

What is the IUPAC name of 2-(6-methoxy-1-benzofuran-3-yl)-N-(1-phenylcyclobutyl)acetamide?
The IUPAC name of 2-(6-methoxy-1-benzofuran-3-yl)-N-(1-phenylcyclobutyl)acetamide (CID 55462664) is 2-(6-methoxy-1-benzofuran-3-yl)-N-(1-phenylcyclobutyl)acetamide.
What is the SMILES notation for 2-(6-methoxy-1-benzofuran-3-yl)-N-(1-phenylcyclobutyl)acetamide?
The canonical SMILES for 2-(6-methoxy-1-benzofuran-3-yl)-N-(1-phenylcyclobutyl)acetamide is COc1ccc2c(CC(=O)NC3(c4ccccc4)CCC3)coc2c1.
What is the InChIKey of 2-(6-methoxy-1-benzofuran-3-yl)-N-(1-phenylcyclobutyl)acetamide?
The InChIKey is IZFOOZFAXDETKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21NO3/c1-24-17-8-9-18-15(14-25-19(18)13-17)12-20(23)22-21(10-5-11-21)16-6-3-2-4-7-16/h2-4,6-9,13-14H,5,10-12H2,1H3,(H,22,23).
What are the key properties of 2-(6-methoxy-1-benzofuran-3-yl)-N-(1-phenylcyclobutyl)acetamide?
2-(6-methoxy-1-benzofuran-3-yl)-N-(1-phenylcyclobutyl)acetamide has a molecular weight of 335.40 g/mol, XLogP of 4.18, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-methoxy-1-benzofuran-3-yl)-N-(1-phenylcyclobutyl)acetamide is sourced from PubChem (CID 55462664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).