N-[2-(4-chlorophenoxy)ethyl]-2-(1-methylindol-4-yl)oxyacetamide

C19H19ClN2O3 — CID 110205383

IUPACN-[2-(4-chlorophenoxy)ethyl]-2-(1-methylindol-4-yl)oxyacetamide
SMILESCn1ccc2c(OCC(=O)NCCOc3ccc(Cl)cc3)cccc21
InChIInChI=1S/C19H19ClN2O3/c1-22-11-9-16-17(22)3-2-4-18(16)25-13-19(23)21-10-12-24-15-7-5-14(20)6-8-15/h2-9,11H,10,12-13H2,1H3,(H,21,23)
InChIKeyCQUDCVLHVNMSCF-UHFFFAOYSA-N
MW358.83 g/mol
LogP3.41
Rot. Bonds7

About N-[2-(4-chlorophenoxy)ethyl]-2-(1-methylindol-4-yl)oxyacetamide

N-[2-(4-chlorophenoxy)ethyl]-2-(1-methylindol-4-yl)oxyacetamide (PubChem CID 110205383) has the molecular formula C19H19ClN2O3 and a molecular weight of 358.83 g/mol. Its IUPAC name is N-[2-(4-chlorophenoxy)ethyl]-2-(1-methylindol-4-yl)oxyacetamide.

Molecular Properties

Compound NameN-[2-(4-chlorophenoxy)ethyl]-2-(1-methylindol-4-yl)oxyacetamide
PubChem CID110205383
Molecular FormulaC19H19ClN2O3
Molecular Weight358.83 g/mol
Exact Mass358.11
IUPAC NameN-[2-(4-chlorophenoxy)ethyl]-2-(1-methylindol-4-yl)oxyacetamide
SMILESCn1ccc2c(OCC(=O)NCCOc3ccc(Cl)cc3)cccc21
InChIInChI=1S/C19H19ClN2O3/c1-22-11-9-16-17(22)3-2-4-18(16)25-13-19(23)21-10-12-24-15-7-5-14(20)6-8-15/h2-9,11H,10,12-13H2,1H3,(H,21,23)
InChIKeyCQUDCVLHVNMSCF-UHFFFAOYSA-N
XLogP3.41
TPSA52.49 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.83
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-[2-(4-chlorophenoxy)ethyl]-2-(2-methoxyphenoxy)acetamide
CID 9007896
2-(1-methylindol-4-yl)oxy-N-(3-morpholin-4-ylpropyl)acetamide
CID 110204153
N-(6-chloro-3-pyridinyl)-2-(1-methylindol-4-yl)oxyacetamide
CID 91822344
methyl 3-[2-[2-(4-chlorophenoxy)ethylamino]-2-oxoethoxy]benzoate
CID 8806513
2-(4-chloro-2-methylphenoxy)-N-(2-phenoxyethyl)acetamide
CID 26903383
N-[2-(4-chloro-3-methylphenoxy)ethyl]-2-(4-chlorophenoxy)acetamide
CID 113102711
N-[2-(4-chlorophenoxy)ethyl]-4-phenoxybutanamide
CID 94868069
2-(4-chlorophenoxy)-N-[2-(2,4-dimethylphenoxy)ethyl]acetamide
CID 9194409
[2-[2-(4-chlorophenoxy)ethylamino]-2-oxoethyl] 3-methylbenzoate
CID 9290573
N-(2-methoxy-3-pyridinyl)-2-(1-methylindol-4-yl)oxyacetamide
CID 91821935
2-(4-chlorophenoxy)-N-[2-(1-methylpyrrol-3-yl)ethyl]acetamide
CID 110789180
2-(4-chlorophenoxy)-N-[(1-methylpyrazol-3-yl)methyl]acetamide
CID 19329147

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-chlorophenoxy)ethyl]-2-(1-methylindol-4-yl)oxyacetamide?
The IUPAC name of N-[2-(4-chlorophenoxy)ethyl]-2-(1-methylindol-4-yl)oxyacetamide (CID 110205383) is N-[2-(4-chlorophenoxy)ethyl]-2-(1-methylindol-4-yl)oxyacetamide.
What is the SMILES notation for N-[2-(4-chlorophenoxy)ethyl]-2-(1-methylindol-4-yl)oxyacetamide?
The canonical SMILES for N-[2-(4-chlorophenoxy)ethyl]-2-(1-methylindol-4-yl)oxyacetamide is Cn1ccc2c(OCC(=O)NCCOc3ccc(Cl)cc3)cccc21.
What is the InChIKey of N-[2-(4-chlorophenoxy)ethyl]-2-(1-methylindol-4-yl)oxyacetamide?
The InChIKey is CQUDCVLHVNMSCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19ClN2O3/c1-22-11-9-16-17(22)3-2-4-18(16)25-13-19(23)21-10-12-24-15-7-5-14(20)6-8-15/h2-9,11H,10,12-13H2,1H3,(H,21,23).
What are the key properties of N-[2-(4-chlorophenoxy)ethyl]-2-(1-methylindol-4-yl)oxyacetamide?
N-[2-(4-chlorophenoxy)ethyl]-2-(1-methylindol-4-yl)oxyacetamide has a molecular weight of 358.83 g/mol, XLogP of 3.41, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-chlorophenoxy)ethyl]-2-(1-methylindol-4-yl)oxyacetamide is sourced from PubChem (CID 110205383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).