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

C17H23NO2 — CID 34439811

IUPAC3-cyclohexyl-N-(2,3-dihydro-1-benzofuran-5-yl)propanamide
SMILESO=C(CCC1CCCCC1)Nc1ccc2c(c1)CCO2
InChIInChI=1S/C17H23NO2/c19-17(9-6-13-4-2-1-3-5-13)18-15-7-8-16-14(12-15)10-11-20-16/h7-8,12-13H,1-6,9-11H2,(H,18,19)
InChIKeyFZGKCUYNYFJINR-UHFFFAOYSA-N
MW273.38 g/mol
LogP3.92
Rot. Bonds4

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

3-cyclohexyl-N-(2,3-dihydro-1-benzofuran-5-yl)propanamide (PubChem CID 34439811) has the molecular formula C17H23NO2 and a molecular weight of 273.38 g/mol. Its IUPAC name is 3-cyclohexyl-N-(2,3-dihydro-1-benzofuran-5-yl)propanamide.

Molecular Properties

Compound Name3-cyclohexyl-N-(2,3-dihydro-1-benzofuran-5-yl)propanamide
PubChem CID34439811
Molecular FormulaC17H23NO2
Molecular Weight273.38 g/mol
Exact Mass273.17
IUPAC Name3-cyclohexyl-N-(2,3-dihydro-1-benzofuran-5-yl)propanamide
SMILESO=C(CCC1CCCCC1)Nc1ccc2c(c1)CCO2
InChIInChI=1S/C17H23NO2/c19-17(9-6-13-4-2-1-3-5-13)18-15-7-8-16-14(12-15)10-11-20-16/h7-8,12-13H,1-6,9-11H2,(H,18,19)
InChIKeyFZGKCUYNYFJINR-UHFFFAOYSA-N
XLogP3.92
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.38
LogP ≤ 53.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-cyclohexyl-N-(2,3-dihydro-1-benzofuran-5-yl)propanamide?
The IUPAC name of 3-cyclohexyl-N-(2,3-dihydro-1-benzofuran-5-yl)propanamide (CID 34439811) is 3-cyclohexyl-N-(2,3-dihydro-1-benzofuran-5-yl)propanamide.
What is the SMILES notation for 3-cyclohexyl-N-(2,3-dihydro-1-benzofuran-5-yl)propanamide?
The canonical SMILES for 3-cyclohexyl-N-(2,3-dihydro-1-benzofuran-5-yl)propanamide is O=C(CCC1CCCCC1)Nc1ccc2c(c1)CCO2.
What is the InChIKey of 3-cyclohexyl-N-(2,3-dihydro-1-benzofuran-5-yl)propanamide?
The InChIKey is FZGKCUYNYFJINR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23NO2/c19-17(9-6-13-4-2-1-3-5-13)18-15-7-8-16-14(12-15)10-11-20-16/h7-8,12-13H,1-6,9-11H2,(H,18,19).
What are the key properties of 3-cyclohexyl-N-(2,3-dihydro-1-benzofuran-5-yl)propanamide?
3-cyclohexyl-N-(2,3-dihydro-1-benzofuran-5-yl)propanamide has a molecular weight of 273.38 g/mol, XLogP of 3.92, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclohexyl-N-(2,3-dihydro-1-benzofuran-5-yl)propanamide is sourced from PubChem (CID 34439811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).