2-chloro-N-[4-(4-chlorophenoxy)phenyl]acetamide

C14H11Cl2NO2 — CID 2782070

IUPAC2-chloro-N-[4-(4-chlorophenoxy)phenyl]acetamide
SMILESO=C(CCl)Nc1ccc(Oc2ccc(Cl)cc2)cc1
InChIInChI=1S/C14H11Cl2NO2/c15-9-14(18)17-11-3-7-13(8-4-11)19-12-5-1-10(16)2-6-12/h1-8H,9H2,(H,17,18)
InChIKeyLQBGPTCOVFQOIC-UHFFFAOYSA-N
MW296.15 g/mol
LogP4.31
Rot. Bonds4

About 2-chloro-N-[4-(4-chlorophenoxy)phenyl]acetamide

2-chloro-N-[4-(4-chlorophenoxy)phenyl]acetamide (PubChem CID 2782070) has the molecular formula C14H11Cl2NO2 and a molecular weight of 296.15 g/mol. Its IUPAC name is 2-chloro-N-[4-(4-chlorophenoxy)phenyl]acetamide.

Molecular Properties

Compound Name2-chloro-N-[4-(4-chlorophenoxy)phenyl]acetamide
PubChem CID2782070
Molecular FormulaC14H11Cl2NO2
Molecular Weight296.15 g/mol
Exact Mass295.02
IUPAC Name2-chloro-N-[4-(4-chlorophenoxy)phenyl]acetamide
SMILESO=C(CCl)Nc1ccc(Oc2ccc(Cl)cc2)cc1
InChIInChI=1S/C14H11Cl2NO2/c15-9-14(18)17-11-3-7-13(8-4-11)19-12-5-1-10(16)2-6-12/h1-8H,9H2,(H,17,18)
InChIKeyLQBGPTCOVFQOIC-UHFFFAOYSA-N
XLogP4.31
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.15
LogP ≤ 54.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

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Related Compounds

N-[4-(4-bromophenoxy)phenyl]-2-(4-chlorophenyl)acetamide
CID 4575386
2-chloro-N-[4-(3-fluorophenoxy)phenyl]acetamide
CID 39379903
2-chloro-N-[4-(2-methoxyphenoxy)phenyl]acetamide
CID 39398752
2-(1-adamantyl)-N-[4-(4-chlorophenoxy)phenyl]acetamide
CID 3621040
2-chloro-N-[4-(4-methoxyanilino)phenyl]acetamide
CID 13013378
N,N'-bis(4-chlorophenyl)-3-oxopentanediamide
CID 12654887
N-[4-(4-chlorophenoxy)phenyl]-2-piperidin-1-ylacetamide;oxalic acid
CID 71374350
N-[4-(4-chlorophenoxy)phenyl]-2-[2-(dimethylamino)ethylsulfanyl]acetamide
CID 38113456
N-[4-(4-chlorophenoxy)phenyl]-2-methylprop-2-enamide
CID 139520073
2-(4-chlorophenyl)-N-[4-(3-methylphenoxy)phenyl]acetamide
CID 5085866
3-chloro-N-[4-(4-methylphenoxy)phenyl]propanamide
CID 43168007
N-(4-chlorophenyl)-3-(4-methoxyanilino)propanamide
CID 109038116

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[4-(4-chlorophenoxy)phenyl]acetamide?
The IUPAC name of 2-chloro-N-[4-(4-chlorophenoxy)phenyl]acetamide (CID 2782070) is 2-chloro-N-[4-(4-chlorophenoxy)phenyl]acetamide.
What is the SMILES notation for 2-chloro-N-[4-(4-chlorophenoxy)phenyl]acetamide?
The canonical SMILES for 2-chloro-N-[4-(4-chlorophenoxy)phenyl]acetamide is O=C(CCl)Nc1ccc(Oc2ccc(Cl)cc2)cc1.
What is the InChIKey of 2-chloro-N-[4-(4-chlorophenoxy)phenyl]acetamide?
The InChIKey is LQBGPTCOVFQOIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11Cl2NO2/c15-9-14(18)17-11-3-7-13(8-4-11)19-12-5-1-10(16)2-6-12/h1-8H,9H2,(H,17,18).
What are the key properties of 2-chloro-N-[4-(4-chlorophenoxy)phenyl]acetamide?
2-chloro-N-[4-(4-chlorophenoxy)phenyl]acetamide has a molecular weight of 296.15 g/mol, XLogP of 4.31, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-[4-(4-chlorophenoxy)phenyl]acetamide is sourced from PubChem (CID 2782070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).