N-(2-chlorophenyl)-2,3-dihydro-1-benzofuran-2-carboxamide

C15H12ClNO2 — CID 18089270

IUPACN-(2-chlorophenyl)-2,3-dihydro-1-benzofuran-2-carboxamide
SMILESO=C(Nc1ccccc1Cl)C1Cc2ccccc2O1
InChIInChI=1S/C15H12ClNO2/c16-11-6-2-3-7-12(11)17-15(18)14-9-10-5-1-4-8-13(10)19-14/h1-8,14H,9H2,(H,17,18)
InChIKeyWIROBYJAWGXXPN-UHFFFAOYSA-N
MW273.72 g/mol
LogP3.28
Rot. Bonds2

About N-(2-chlorophenyl)-2,3-dihydro-1-benzofuran-2-carboxamide

N-(2-chlorophenyl)-2,3-dihydro-1-benzofuran-2-carboxamide (PubChem CID 18089270) has the molecular formula C15H12ClNO2 and a molecular weight of 273.72 g/mol. Its IUPAC name is N-(2-chlorophenyl)-2,3-dihydro-1-benzofuran-2-carboxamide.

Molecular Properties

Compound NameN-(2-chlorophenyl)-2,3-dihydro-1-benzofuran-2-carboxamide
PubChem CID18089270
Molecular FormulaC15H12ClNO2
Molecular Weight273.72 g/mol
Exact Mass273.06
IUPAC NameN-(2-chlorophenyl)-2,3-dihydro-1-benzofuran-2-carboxamide
SMILESO=C(Nc1ccccc1Cl)C1Cc2ccccc2O1
InChIInChI=1S/C15H12ClNO2/c16-11-6-2-3-7-12(11)17-15(18)14-9-10-5-1-4-8-13(10)19-14/h1-8,14H,9H2,(H,17,18)
InChIKeyWIROBYJAWGXXPN-UHFFFAOYSA-N
XLogP3.28
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.72
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2-chlorophenyl)-2,3-dihydro-1-benzofuran-2-carboxamide?
The IUPAC name of N-(2-chlorophenyl)-2,3-dihydro-1-benzofuran-2-carboxamide (CID 18089270) is N-(2-chlorophenyl)-2,3-dihydro-1-benzofuran-2-carboxamide.
What is the SMILES notation for N-(2-chlorophenyl)-2,3-dihydro-1-benzofuran-2-carboxamide?
The canonical SMILES for N-(2-chlorophenyl)-2,3-dihydro-1-benzofuran-2-carboxamide is O=C(Nc1ccccc1Cl)C1Cc2ccccc2O1.
What is the InChIKey of N-(2-chlorophenyl)-2,3-dihydro-1-benzofuran-2-carboxamide?
The InChIKey is WIROBYJAWGXXPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12ClNO2/c16-11-6-2-3-7-12(11)17-15(18)14-9-10-5-1-4-8-13(10)19-14/h1-8,14H,9H2,(H,17,18).
What are the key properties of N-(2-chlorophenyl)-2,3-dihydro-1-benzofuran-2-carboxamide?
N-(2-chlorophenyl)-2,3-dihydro-1-benzofuran-2-carboxamide has a molecular weight of 273.72 g/mol, XLogP of 3.28, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chlorophenyl)-2,3-dihydro-1-benzofuran-2-carboxamide is sourced from PubChem (CID 18089270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).