2,3-dihydro-1-benzofuran-7-carboxamide

C9H9NO2 — CID 19963762

IUPAC2,3-dihydro-1-benzofuran-7-carboxamide
SMILESNC(=O)c1cccc2c1OCC2
InChIInChI=1S/C9H9NO2/c10-9(11)7-3-1-2-6-4-5-12-8(6)7/h1-3H,4-5H2,(H2,10,11)
InChIKeyWJVVPYVGCDWJKB-UHFFFAOYSA-N
MW163.18 g/mol
LogP0.72
Rot. Bonds1

About 2,3-dihydro-1-benzofuran-7-carboxamide

2,3-dihydro-1-benzofuran-7-carboxamide (PubChem CID 19963762) has the molecular formula C9H9NO2 and a molecular weight of 163.18 g/mol. Its IUPAC name is 2,3-dihydro-1-benzofuran-7-carboxamide.

Molecular Properties

Compound Name2,3-dihydro-1-benzofuran-7-carboxamide
PubChem CID19963762
Molecular FormulaC9H9NO2
Molecular Weight163.18 g/mol
Exact Mass163.06
IUPAC Name2,3-dihydro-1-benzofuran-7-carboxamide
SMILESNC(=O)c1cccc2c1OCC2
InChIInChI=1S/C9H9NO2/c10-9(11)7-3-1-2-6-4-5-12-8(6)7/h1-3H,4-5H2,(H2,10,11)
InChIKeyWJVVPYVGCDWJKB-UHFFFAOYSA-N
XLogP0.72
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.18
LogP ≤ 50.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,3-dihydro-1-benzofuran-7-carboxamide?
The IUPAC name of 2,3-dihydro-1-benzofuran-7-carboxamide (CID 19963762) is 2,3-dihydro-1-benzofuran-7-carboxamide.
What is the SMILES notation for 2,3-dihydro-1-benzofuran-7-carboxamide?
The canonical SMILES for 2,3-dihydro-1-benzofuran-7-carboxamide is NC(=O)c1cccc2c1OCC2.
What is the InChIKey of 2,3-dihydro-1-benzofuran-7-carboxamide?
The InChIKey is WJVVPYVGCDWJKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9NO2/c10-9(11)7-3-1-2-6-4-5-12-8(6)7/h1-3H,4-5H2,(H2,10,11).
What are the key properties of 2,3-dihydro-1-benzofuran-7-carboxamide?
2,3-dihydro-1-benzofuran-7-carboxamide has a molecular weight of 163.18 g/mol, XLogP of 0.72, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydro-1-benzofuran-7-carboxamide is sourced from PubChem (CID 19963762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).