N-[4-[2-(4-ethoxyphenoxy)ethylcarbamoylamino]phenyl]acetamide

C19H23N3O4 — CID 112973214

IUPACN-[4-[2-(4-ethoxyphenoxy)ethylcarbamoylamino]phenyl]acetamide
SMILESCCOc1ccc(OCCNC(=O)Nc2ccc(NC(C)=O)cc2)cc1
InChIInChI=1S/C19H23N3O4/c1-3-25-17-8-10-18(11-9-17)26-13-12-20-19(24)22-16-6-4-15(5-7-16)21-14(2)23/h4-11H,3,12-13H2,1-2H3,(H,21,23)(H2,20,22,24)
InChIKeyJGZUITIQVQXVGM-UHFFFAOYSA-N
MW357.41 g/mol
LogP3.24
Rot. Bonds8

About N-[4-[2-(4-ethoxyphenoxy)ethylcarbamoylamino]phenyl]acetamide

N-[4-[2-(4-ethoxyphenoxy)ethylcarbamoylamino]phenyl]acetamide (PubChem CID 112973214) has the molecular formula C19H23N3O4 and a molecular weight of 357.41 g/mol. Its IUPAC name is N-[4-[2-(4-ethoxyphenoxy)ethylcarbamoylamino]phenyl]acetamide.

Molecular Properties

Compound NameN-[4-[2-(4-ethoxyphenoxy)ethylcarbamoylamino]phenyl]acetamide
PubChem CID112973214
Molecular FormulaC19H23N3O4
Molecular Weight357.41 g/mol
Exact Mass357.17
IUPAC NameN-[4-[2-(4-ethoxyphenoxy)ethylcarbamoylamino]phenyl]acetamide
SMILESCCOc1ccc(OCCNC(=O)Nc2ccc(NC(C)=O)cc2)cc1
InChIInChI=1S/C19H23N3O4/c1-3-25-17-8-10-18(11-9-17)26-13-12-20-19(24)22-16-6-4-15(5-7-16)21-14(2)23/h4-11H,3,12-13H2,1-2H3,(H,21,23)(H2,20,22,24)
InChIKeyJGZUITIQVQXVGM-UHFFFAOYSA-N
XLogP3.24
TPSA88.69 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.41
LogP ≤ 53.24
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

1-[2-(4-chlorophenoxy)ethyl]-3-(4-ethoxyphenyl)urea
CID 112970962
N-[4-[2-(4-fluorophenoxy)ethylcarbamoylamino]phenyl]acetamide
CID 52595243
1-[2-(3,5-dimethoxyphenoxy)ethyl]-3-(4-ethoxyphenyl)urea
CID 112975715
1-(3-bromo-4-methylphenyl)-3-[2-(4-ethoxyphenoxy)ethyl]urea
CID 112973207
1-[2-(4-ethoxyphenoxy)ethyl]-3-(3-methylphenyl)urea
CID 27871438
1-(4-ethoxyphenyl)-3-[2-(2-propan-2-ylphenoxy)ethyl]urea
CID 112972292
N-[4-[2-(ethylamino)ethoxy]phenyl]acetamide
CID 103074267
1-[2-(4-methoxyphenoxy)ethyl]-3-(4-methylphenyl)urea
CID 51244378
1-(4-bromophenyl)-3-[2-(4-ethylphenoxy)ethyl]urea
CID 112972120
1-(4-ethylphenyl)-3-[2-(4-fluorophenoxy)ethyl]urea
CID 112970481
1-(4-ethoxyphenyl)-3-[3-(2-methylphenoxy)propyl]urea
CID 108883788
1-(2,6-dimethylphenyl)-3-[2-(4-ethoxyphenoxy)ethyl]urea
CID 112973189

Frequently Asked Questions

What is the IUPAC name of N-[4-[2-(4-ethoxyphenoxy)ethylcarbamoylamino]phenyl]acetamide?
The IUPAC name of N-[4-[2-(4-ethoxyphenoxy)ethylcarbamoylamino]phenyl]acetamide (CID 112973214) is N-[4-[2-(4-ethoxyphenoxy)ethylcarbamoylamino]phenyl]acetamide.
What is the SMILES notation for N-[4-[2-(4-ethoxyphenoxy)ethylcarbamoylamino]phenyl]acetamide?
The canonical SMILES for N-[4-[2-(4-ethoxyphenoxy)ethylcarbamoylamino]phenyl]acetamide is CCOc1ccc(OCCNC(=O)Nc2ccc(NC(C)=O)cc2)cc1.
What is the InChIKey of N-[4-[2-(4-ethoxyphenoxy)ethylcarbamoylamino]phenyl]acetamide?
The InChIKey is JGZUITIQVQXVGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O4/c1-3-25-17-8-10-18(11-9-17)26-13-12-20-19(24)22-16-6-4-15(5-7-16)21-14(2)23/h4-11H,3,12-13H2,1-2H3,(H,21,23)(H2,20,22,24).
What are the key properties of N-[4-[2-(4-ethoxyphenoxy)ethylcarbamoylamino]phenyl]acetamide?
N-[4-[2-(4-ethoxyphenoxy)ethylcarbamoylamino]phenyl]acetamide has a molecular weight of 357.41 g/mol, XLogP of 3.24, 8 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[2-(4-ethoxyphenoxy)ethylcarbamoylamino]phenyl]acetamide is sourced from PubChem (CID 112973214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).