N-[3-chloro-4-ethoxy-5-(methoxymethyl)phenyl]-2-phenoxyacetamide

C18H20ClNO4 — CID 13343268

IUPACN-[3-chloro-4-ethoxy-5-(methoxymethyl)phenyl]-2-phenoxyacetamide
SMILESCCOc1c(Cl)cc(NC(=O)COc2ccccc2)cc1COC
InChIInChI=1S/C18H20ClNO4/c1-3-23-18-13(11-22-2)9-14(10-16(18)19)20-17(21)12-24-15-7-5-4-6-8-15/h4-10H,3,11-12H2,1-2H3,(H,20,21)
InChIKeyHXHYFGWSHCLPOC-UHFFFAOYSA-N
MW349.81 g/mol
LogP3.90
Rot. Bonds8

About N-[3-chloro-4-ethoxy-5-(methoxymethyl)phenyl]-2-phenoxyacetamide

N-[3-chloro-4-ethoxy-5-(methoxymethyl)phenyl]-2-phenoxyacetamide (PubChem CID 13343268) has the molecular formula C18H20ClNO4 and a molecular weight of 349.81 g/mol. Its IUPAC name is N-[3-chloro-4-ethoxy-5-(methoxymethyl)phenyl]-2-phenoxyacetamide.

Molecular Properties

Compound NameN-[3-chloro-4-ethoxy-5-(methoxymethyl)phenyl]-2-phenoxyacetamide
PubChem CID13343268
Molecular FormulaC18H20ClNO4
Molecular Weight349.81 g/mol
Exact Mass349.11
IUPAC NameN-[3-chloro-4-ethoxy-5-(methoxymethyl)phenyl]-2-phenoxyacetamide
SMILESCCOc1c(Cl)cc(NC(=O)COc2ccccc2)cc1COC
InChIInChI=1S/C18H20ClNO4/c1-3-23-18-13(11-22-2)9-14(10-16(18)19)20-17(21)12-24-15-7-5-4-6-8-15/h4-10H,3,11-12H2,1-2H3,(H,20,21)
InChIKeyHXHYFGWSHCLPOC-UHFFFAOYSA-N
XLogP3.90
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.81
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-chloro-4-ethoxy-5-(methoxymethyl)phenyl]propanamide
CID 13343257
N-(3-chloro-4-fluorophenyl)-2-phenoxyacetamide
CID 924892
ethyl 3,5-bis[(2-phenoxyacetyl)amino]benzoate
CID 15008323
N-(3,4-dichlorophenyl)-2-(4-phenoxyphenoxy)acetamide
CID 2319916
2-(4-chloro-3-ethylphenoxy)-N-phenylacetamide
CID 7642625
2-(3-ethoxyphenoxy)-N-(4-phenylmethoxyphenyl)acetamide
CID 112977838
N-(4-chlorophenyl)-2-(3-ethoxyphenoxy)acetamide
CID 112977797
N-(4-ethoxyphenyl)-2-(2,3,4,6-tetrachlorophenoxy)acetamide
CID 45050935
N-(4-acetamidophenyl)-2-phenoxyacetamide
CID 675023
N-[3-[[2-(4-methoxyphenoxy)acetyl]amino]phenyl]-2-phenoxyacetamide
CID 17231339
2-(3-ethoxyphenoxy)-N-(4-phenoxyphenyl)acetamide
CID 112977837
N-(3,5-dichlorophenyl)-2-(4-phenylmethoxyphenoxy)acetamide
CID 7926056

Frequently Asked Questions

What is the IUPAC name of N-[3-chloro-4-ethoxy-5-(methoxymethyl)phenyl]-2-phenoxyacetamide?
The IUPAC name of N-[3-chloro-4-ethoxy-5-(methoxymethyl)phenyl]-2-phenoxyacetamide (CID 13343268) is N-[3-chloro-4-ethoxy-5-(methoxymethyl)phenyl]-2-phenoxyacetamide.
What is the SMILES notation for N-[3-chloro-4-ethoxy-5-(methoxymethyl)phenyl]-2-phenoxyacetamide?
The canonical SMILES for N-[3-chloro-4-ethoxy-5-(methoxymethyl)phenyl]-2-phenoxyacetamide is CCOc1c(Cl)cc(NC(=O)COc2ccccc2)cc1COC.
What is the InChIKey of N-[3-chloro-4-ethoxy-5-(methoxymethyl)phenyl]-2-phenoxyacetamide?
The InChIKey is HXHYFGWSHCLPOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20ClNO4/c1-3-23-18-13(11-22-2)9-14(10-16(18)19)20-17(21)12-24-15-7-5-4-6-8-15/h4-10H,3,11-12H2,1-2H3,(H,20,21).
What are the key properties of N-[3-chloro-4-ethoxy-5-(methoxymethyl)phenyl]-2-phenoxyacetamide?
N-[3-chloro-4-ethoxy-5-(methoxymethyl)phenyl]-2-phenoxyacetamide has a molecular weight of 349.81 g/mol, XLogP of 3.90, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-chloro-4-ethoxy-5-(methoxymethyl)phenyl]-2-phenoxyacetamide is sourced from PubChem (CID 13343268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).