2,3-dichloro-N-(furan-2-ylmethyl)benzamide

C12H9Cl2NO2 — CID 2278558

IUPAC2,3-dichloro-N-(furan-2-ylmethyl)benzamide
SMILESO=C(NCc1ccco1)c1cccc(Cl)c1Cl
InChIInChI=1S/C12H9Cl2NO2/c13-10-5-1-4-9(11(10)14)12(16)15-7-8-3-2-6-17-8/h1-6H,7H2,(H,15,16)
InChIKeyRZQJZPWBMZJVPG-UHFFFAOYSA-N
MW270.12 g/mol
LogP3.52
Rot. Bonds3

About 2,3-dichloro-N-(furan-2-ylmethyl)benzamide

2,3-dichloro-N-(furan-2-ylmethyl)benzamide (PubChem CID 2278558) has the molecular formula C12H9Cl2NO2 and a molecular weight of 270.12 g/mol. Its IUPAC name is 2,3-dichloro-N-(furan-2-ylmethyl)benzamide.

Molecular Properties

Compound Name2,3-dichloro-N-(furan-2-ylmethyl)benzamide
PubChem CID2278558
Molecular FormulaC12H9Cl2NO2
Molecular Weight270.12 g/mol
Exact Mass269.00
IUPAC Name2,3-dichloro-N-(furan-2-ylmethyl)benzamide
SMILESO=C(NCc1ccco1)c1cccc(Cl)c1Cl
InChIInChI=1S/C12H9Cl2NO2/c13-10-5-1-4-9(11(10)14)12(16)15-7-8-3-2-6-17-8/h1-6H,7H2,(H,15,16)
InChIKeyRZQJZPWBMZJVPG-UHFFFAOYSA-N
XLogP3.52
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.12
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,3-dichloro-N-(furan-2-ylmethyl)benzamide?
The IUPAC name of 2,3-dichloro-N-(furan-2-ylmethyl)benzamide (CID 2278558) is 2,3-dichloro-N-(furan-2-ylmethyl)benzamide.
What is the SMILES notation for 2,3-dichloro-N-(furan-2-ylmethyl)benzamide?
The canonical SMILES for 2,3-dichloro-N-(furan-2-ylmethyl)benzamide is O=C(NCc1ccco1)c1cccc(Cl)c1Cl.
What is the InChIKey of 2,3-dichloro-N-(furan-2-ylmethyl)benzamide?
The InChIKey is RZQJZPWBMZJVPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9Cl2NO2/c13-10-5-1-4-9(11(10)14)12(16)15-7-8-3-2-6-17-8/h1-6H,7H2,(H,15,16).
What are the key properties of 2,3-dichloro-N-(furan-2-ylmethyl)benzamide?
2,3-dichloro-N-(furan-2-ylmethyl)benzamide has a molecular weight of 270.12 g/mol, XLogP of 3.52, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dichloro-N-(furan-2-ylmethyl)benzamide is sourced from PubChem (CID 2278558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).