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

C18H23NO3 — CID 2477196

IUPACN-cycloheptyl-2-(6-methoxy-1-benzofuran-3-yl)acetamide
SMILESCOc1ccc2c(CC(=O)NC3CCCCCC3)coc2c1
InChIInChI=1S/C18H23NO3/c1-21-15-8-9-16-13(12-22-17(16)11-15)10-18(20)19-14-6-4-2-3-5-7-14/h8-9,11-12,14H,2-7,10H2,1H3,(H,19,20)
InChIKeyWADVZALESXZUKZ-UHFFFAOYSA-N
MW301.39 g/mol
LogP3.82
Rot. Bonds4

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

N-cycloheptyl-2-(6-methoxy-1-benzofuran-3-yl)acetamide (PubChem CID 2477196) has the molecular formula C18H23NO3 and a molecular weight of 301.39 g/mol. Its IUPAC name is N-cycloheptyl-2-(6-methoxy-1-benzofuran-3-yl)acetamide.

Molecular Properties

Compound NameN-cycloheptyl-2-(6-methoxy-1-benzofuran-3-yl)acetamide
PubChem CID2477196
Molecular FormulaC18H23NO3
Molecular Weight301.39 g/mol
Exact Mass301.17
IUPAC NameN-cycloheptyl-2-(6-methoxy-1-benzofuran-3-yl)acetamide
SMILESCOc1ccc2c(CC(=O)NC3CCCCCC3)coc2c1
InChIInChI=1S/C18H23NO3/c1-21-15-8-9-16-13(12-22-17(16)11-15)10-18(20)19-14-6-4-2-3-5-7-14/h8-9,11-12,14H,2-7,10H2,1H3,(H,19,20)
InChIKeyWADVZALESXZUKZ-UHFFFAOYSA-N
XLogP3.82
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.39
LogP ≤ 53.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-aminocyclohexyl)-2-(6-methoxy-1-benzofuran-3-yl)acetamide;hydrochloride
CID 119476883
N-(2-amino-1-cyclohexylethyl)-2-(6-methoxy-1-benzofuran-3-yl)acetamide
CID 119590691
cis-(1S,3R)-3-[[2-(6-methoxy-1-benzofuran-3-yl)acetyl]amino]cyclopentane-1-carboxylic acid
CID 120677153
2-(6-methoxy-1-benzofuran-3-yl)-N-pyrrolidin-3-ylacetamide;hydrochloride
CID 119452018
2-(6-methoxy-1-benzofuran-3-yl)-N-(1-propylpiperidin-4-yl)acetamide
CID 78809882
2-(6-methoxy-1-benzofuran-3-yl)-N-[1-(1-methylpyrazol-4-yl)piperidin-3-yl]acetamide
CID 126766814
N-cycloheptyl-2-(2,5-dimethoxyphenyl)acetamide
CID 7580886
2-(6-methoxy-1-benzofuran-3-yl)-N-[2-oxo-2-(propan-2-ylamino)ethyl]acetamide
CID 27742710
N-cyclohexyl-2-[3-(4-methoxyphenoxy)-4-oxochromen-7-yl]oxyacetamide
CID 1192171
2-(1-benzofuran-3-yl)-N-cyclopentylacetamide
CID 110848759
2-(6-methoxy-1-benzofuran-3-yl)-N-(2-methoxyethyl)acetamide
CID 29290752
2-(6-methoxy-1-benzofuran-3-yl)-N-[(6R)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]acetamide
CID 95138605

Frequently Asked Questions

What is the IUPAC name of N-cycloheptyl-2-(6-methoxy-1-benzofuran-3-yl)acetamide?
The IUPAC name of N-cycloheptyl-2-(6-methoxy-1-benzofuran-3-yl)acetamide (CID 2477196) is N-cycloheptyl-2-(6-methoxy-1-benzofuran-3-yl)acetamide.
What is the SMILES notation for N-cycloheptyl-2-(6-methoxy-1-benzofuran-3-yl)acetamide?
The canonical SMILES for N-cycloheptyl-2-(6-methoxy-1-benzofuran-3-yl)acetamide is COc1ccc2c(CC(=O)NC3CCCCCC3)coc2c1.
What is the InChIKey of N-cycloheptyl-2-(6-methoxy-1-benzofuran-3-yl)acetamide?
The InChIKey is WADVZALESXZUKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23NO3/c1-21-15-8-9-16-13(12-22-17(16)11-15)10-18(20)19-14-6-4-2-3-5-7-14/h8-9,11-12,14H,2-7,10H2,1H3,(H,19,20).
What are the key properties of N-cycloheptyl-2-(6-methoxy-1-benzofuran-3-yl)acetamide?
N-cycloheptyl-2-(6-methoxy-1-benzofuran-3-yl)acetamide has a molecular weight of 301.39 g/mol, XLogP of 3.82, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cycloheptyl-2-(6-methoxy-1-benzofuran-3-yl)acetamide is sourced from PubChem (CID 2477196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).