2-(4-chlorophenoxy)-N-(4-chlorophenyl)-N-(furan-2-ylmethyl)acetamide

C19H15Cl2NO3 — CID 35181974

IUPAC2-(4-chlorophenoxy)-N-(4-chlorophenyl)-N-(furan-2-ylmethyl)acetamide
SMILESO=C(COc1ccc(Cl)cc1)N(Cc1ccco1)c1ccc(Cl)cc1
InChIInChI=1S/C19H15Cl2NO3/c20-14-3-7-16(8-4-14)22(12-18-2-1-11-24-18)19(23)13-25-17-9-5-15(21)6-10-17/h1-11H,12-13H2
InChIKeyZJDDZQUBNSNWJJ-UHFFFAOYSA-N
MW376.24 g/mol
LogP5.20
Rot. Bonds6

About 2-(4-chlorophenoxy)-N-(4-chlorophenyl)-N-(furan-2-ylmethyl)acetamide

2-(4-chlorophenoxy)-N-(4-chlorophenyl)-N-(furan-2-ylmethyl)acetamide (PubChem CID 35181974) has the molecular formula C19H15Cl2NO3 and a molecular weight of 376.24 g/mol. Its IUPAC name is 2-(4-chlorophenoxy)-N-(4-chlorophenyl)-N-(furan-2-ylmethyl)acetamide.

Molecular Properties

Compound Name2-(4-chlorophenoxy)-N-(4-chlorophenyl)-N-(furan-2-ylmethyl)acetamide
PubChem CID35181974
Molecular FormulaC19H15Cl2NO3
Molecular Weight376.24 g/mol
Exact Mass375.04
IUPAC Name2-(4-chlorophenoxy)-N-(4-chlorophenyl)-N-(furan-2-ylmethyl)acetamide
SMILESO=C(COc1ccc(Cl)cc1)N(Cc1ccco1)c1ccc(Cl)cc1
InChIInChI=1S/C19H15Cl2NO3/c20-14-3-7-16(8-4-14)22(12-18-2-1-11-24-18)19(23)13-25-17-9-5-15(21)6-10-17/h1-11H,12-13H2
InChIKeyZJDDZQUBNSNWJJ-UHFFFAOYSA-N
XLogP5.20
TPSA42.68 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500376.24
LogP ≤ 55.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenoxy)-N-(4-chlorophenyl)-N-(furan-2-ylmethyl)acetamide?
The IUPAC name of 2-(4-chlorophenoxy)-N-(4-chlorophenyl)-N-(furan-2-ylmethyl)acetamide (CID 35181974) is 2-(4-chlorophenoxy)-N-(4-chlorophenyl)-N-(furan-2-ylmethyl)acetamide.
What is the SMILES notation for 2-(4-chlorophenoxy)-N-(4-chlorophenyl)-N-(furan-2-ylmethyl)acetamide?
The canonical SMILES for 2-(4-chlorophenoxy)-N-(4-chlorophenyl)-N-(furan-2-ylmethyl)acetamide is O=C(COc1ccc(Cl)cc1)N(Cc1ccco1)c1ccc(Cl)cc1.
What is the InChIKey of 2-(4-chlorophenoxy)-N-(4-chlorophenyl)-N-(furan-2-ylmethyl)acetamide?
The InChIKey is ZJDDZQUBNSNWJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15Cl2NO3/c20-14-3-7-16(8-4-14)22(12-18-2-1-11-24-18)19(23)13-25-17-9-5-15(21)6-10-17/h1-11H,12-13H2.
What are the key properties of 2-(4-chlorophenoxy)-N-(4-chlorophenyl)-N-(furan-2-ylmethyl)acetamide?
2-(4-chlorophenoxy)-N-(4-chlorophenyl)-N-(furan-2-ylmethyl)acetamide has a molecular weight of 376.24 g/mol, XLogP of 5.20, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenoxy)-N-(4-chlorophenyl)-N-(furan-2-ylmethyl)acetamide is sourced from PubChem (CID 35181974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).