3-[2-(3-chlorophenyl)ethoxy]benzamide

C15H14ClNO2 — CID 166632438

IUPAC3-[2-(3-chlorophenyl)ethoxy]benzamide
SMILESNC(=O)c1cccc(OCCc2cccc(Cl)c2)c1
InChIInChI=1S/C15H14ClNO2/c16-13-5-1-3-11(9-13)7-8-19-14-6-2-4-12(10-14)15(17)18/h1-6,9-10H,7-8H2,(H2,17,18)
InChIKeyGMYCMBYPANJMRR-UHFFFAOYSA-N
MW275.74 g/mol
LogP3.06
Rot. Bonds5

About 3-[2-(3-chlorophenyl)ethoxy]benzamide

3-[2-(3-chlorophenyl)ethoxy]benzamide (PubChem CID 166632438) has the molecular formula C15H14ClNO2 and a molecular weight of 275.74 g/mol. Its IUPAC name is 3-[2-(3-chlorophenyl)ethoxy]benzamide.

Molecular Properties

Compound Name3-[2-(3-chlorophenyl)ethoxy]benzamide
PubChem CID166632438
Molecular FormulaC15H14ClNO2
Molecular Weight275.74 g/mol
Exact Mass275.07
IUPAC Name3-[2-(3-chlorophenyl)ethoxy]benzamide
SMILESNC(=O)c1cccc(OCCc2cccc(Cl)c2)c1
InChIInChI=1S/C15H14ClNO2/c16-13-5-1-3-11(9-13)7-8-19-14-6-2-4-12(10-14)15(17)18/h1-6,9-10H,7-8H2,(H2,17,18)
InChIKeyGMYCMBYPANJMRR-UHFFFAOYSA-N
XLogP3.06
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.74
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-[2-(3-chlorophenyl)ethoxy]benzamide?
The IUPAC name of 3-[2-(3-chlorophenyl)ethoxy]benzamide (CID 166632438) is 3-[2-(3-chlorophenyl)ethoxy]benzamide.
What is the SMILES notation for 3-[2-(3-chlorophenyl)ethoxy]benzamide?
The canonical SMILES for 3-[2-(3-chlorophenyl)ethoxy]benzamide is NC(=O)c1cccc(OCCc2cccc(Cl)c2)c1.
What is the InChIKey of 3-[2-(3-chlorophenyl)ethoxy]benzamide?
The InChIKey is GMYCMBYPANJMRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClNO2/c16-13-5-1-3-11(9-13)7-8-19-14-6-2-4-12(10-14)15(17)18/h1-6,9-10H,7-8H2,(H2,17,18).
What are the key properties of 3-[2-(3-chlorophenyl)ethoxy]benzamide?
3-[2-(3-chlorophenyl)ethoxy]benzamide has a molecular weight of 275.74 g/mol, XLogP of 3.06, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(3-chlorophenyl)ethoxy]benzamide is sourced from PubChem (CID 166632438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).