N-(4-chloro-2-methylphenyl)-2-(3-chlorophenoxy)acetamide

C15H13Cl2NO2 — CID 2707661

IUPACN-(4-chloro-2-methylphenyl)-2-(3-chlorophenoxy)acetamide
SMILESCc1cc(Cl)ccc1NC(=O)COc1cccc(Cl)c1
InChIInChI=1S/C15H13Cl2NO2/c1-10-7-12(17)5-6-14(10)18-15(19)9-20-13-4-2-3-11(16)8-13/h2-8H,9H2,1H3,(H,18,19)
InChIKeySDXUNUDYQGDNSP-UHFFFAOYSA-N
MW310.18 g/mol
LogP4.32
Rot. Bonds4

About N-(4-chloro-2-methylphenyl)-2-(3-chlorophenoxy)acetamide

N-(4-chloro-2-methylphenyl)-2-(3-chlorophenoxy)acetamide (PubChem CID 2707661) has the molecular formula C15H13Cl2NO2 and a molecular weight of 310.18 g/mol. Its IUPAC name is N-(4-chloro-2-methylphenyl)-2-(3-chlorophenoxy)acetamide.

Molecular Properties

Compound NameN-(4-chloro-2-methylphenyl)-2-(3-chlorophenoxy)acetamide
PubChem CID2707661
Molecular FormulaC15H13Cl2NO2
Molecular Weight310.18 g/mol
Exact Mass309.03
IUPAC NameN-(4-chloro-2-methylphenyl)-2-(3-chlorophenoxy)acetamide
SMILESCc1cc(Cl)ccc1NC(=O)COc1cccc(Cl)c1
InChIInChI=1S/C15H13Cl2NO2/c1-10-7-12(17)5-6-14(10)18-15(19)9-20-13-4-2-3-11(16)8-13/h2-8H,9H2,1H3,(H,18,19)
InChIKeySDXUNUDYQGDNSP-UHFFFAOYSA-N
XLogP4.32
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.18
LogP ≤ 54.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(4-chloro-2-methylphenyl)-2-(3-chlorophenoxy)acetamide?
The IUPAC name of N-(4-chloro-2-methylphenyl)-2-(3-chlorophenoxy)acetamide (CID 2707661) is N-(4-chloro-2-methylphenyl)-2-(3-chlorophenoxy)acetamide.
What is the SMILES notation for N-(4-chloro-2-methylphenyl)-2-(3-chlorophenoxy)acetamide?
The canonical SMILES for N-(4-chloro-2-methylphenyl)-2-(3-chlorophenoxy)acetamide is Cc1cc(Cl)ccc1NC(=O)COc1cccc(Cl)c1.
What is the InChIKey of N-(4-chloro-2-methylphenyl)-2-(3-chlorophenoxy)acetamide?
The InChIKey is SDXUNUDYQGDNSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13Cl2NO2/c1-10-7-12(17)5-6-14(10)18-15(19)9-20-13-4-2-3-11(16)8-13/h2-8H,9H2,1H3,(H,18,19).
What are the key properties of N-(4-chloro-2-methylphenyl)-2-(3-chlorophenoxy)acetamide?
N-(4-chloro-2-methylphenyl)-2-(3-chlorophenoxy)acetamide has a molecular weight of 310.18 g/mol, XLogP of 4.32, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chloro-2-methylphenyl)-2-(3-chlorophenoxy)acetamide is sourced from PubChem (CID 2707661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).