N-(2,3-dihydro-1-benzofuran-5-ylmethyl)-2-methoxybenzamide

C17H17NO3 — CID 110787049

IUPACN-(2,3-dihydro-1-benzofuran-5-ylmethyl)-2-methoxybenzamide
SMILESCOc1ccccc1C(=O)NCc1ccc2c(c1)CCO2
InChIInChI=1S/C17H17NO3/c1-20-16-5-3-2-4-14(16)17(19)18-11-12-6-7-15-13(10-12)8-9-21-15/h2-7,10H,8-9,11H2,1H3,(H,18,19)
InChIKeyQMLCDFIEVCCOGH-UHFFFAOYSA-N
MW283.33 g/mol
LogP2.56
Rot. Bonds4

About N-(2,3-dihydro-1-benzofuran-5-ylmethyl)-2-methoxybenzamide

N-(2,3-dihydro-1-benzofuran-5-ylmethyl)-2-methoxybenzamide (PubChem CID 110787049) has the molecular formula C17H17NO3 and a molecular weight of 283.33 g/mol. Its IUPAC name is N-(2,3-dihydro-1-benzofuran-5-ylmethyl)-2-methoxybenzamide.

Molecular Properties

Compound NameN-(2,3-dihydro-1-benzofuran-5-ylmethyl)-2-methoxybenzamide
PubChem CID110787049
Molecular FormulaC17H17NO3
Molecular Weight283.33 g/mol
Exact Mass283.12
IUPAC NameN-(2,3-dihydro-1-benzofuran-5-ylmethyl)-2-methoxybenzamide
SMILESCOc1ccccc1C(=O)NCc1ccc2c(c1)CCO2
InChIInChI=1S/C17H17NO3/c1-20-16-5-3-2-4-14(16)17(19)18-11-12-6-7-15-13(10-12)8-9-21-15/h2-7,10H,8-9,11H2,1H3,(H,18,19)
InChIKeyQMLCDFIEVCCOGH-UHFFFAOYSA-N
XLogP2.56
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.33
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydro-1-benzofuran-5-ylmethyl)-2-methoxybenzamide?
The IUPAC name of N-(2,3-dihydro-1-benzofuran-5-ylmethyl)-2-methoxybenzamide (CID 110787049) is N-(2,3-dihydro-1-benzofuran-5-ylmethyl)-2-methoxybenzamide.
What is the SMILES notation for N-(2,3-dihydro-1-benzofuran-5-ylmethyl)-2-methoxybenzamide?
The canonical SMILES for N-(2,3-dihydro-1-benzofuran-5-ylmethyl)-2-methoxybenzamide is COc1ccccc1C(=O)NCc1ccc2c(c1)CCO2.
What is the InChIKey of N-(2,3-dihydro-1-benzofuran-5-ylmethyl)-2-methoxybenzamide?
The InChIKey is QMLCDFIEVCCOGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17NO3/c1-20-16-5-3-2-4-14(16)17(19)18-11-12-6-7-15-13(10-12)8-9-21-15/h2-7,10H,8-9,11H2,1H3,(H,18,19).
What are the key properties of N-(2,3-dihydro-1-benzofuran-5-ylmethyl)-2-methoxybenzamide?
N-(2,3-dihydro-1-benzofuran-5-ylmethyl)-2-methoxybenzamide has a molecular weight of 283.33 g/mol, XLogP of 2.56, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dihydro-1-benzofuran-5-ylmethyl)-2-methoxybenzamide is sourced from PubChem (CID 110787049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).