2-(3-acetamidophenoxy)-N-(cyclohexylcarbamoyl)acetamide

C17H23N3O4 — CID 7698272

IUPAC2-(3-acetamidophenoxy)-N-(cyclohexylcarbamoyl)acetamide
SMILESCC(=O)Nc1cccc(OCC(=O)NC(=O)NC2CCCCC2)c1
InChIInChI=1S/C17H23N3O4/c1-12(21)18-14-8-5-9-15(10-14)24-11-16(22)20-17(23)19-13-6-3-2-4-7-13/h5,8-10,13H,2-4,6-7,11H2,1H3,(H,18,21)(H2,19,20,22,23)
InChIKeyXTGNZUCUGBFUNH-UHFFFAOYSA-N
MW333.39 g/mol
LogP2.18
Rot. Bonds5

About 2-(3-acetamidophenoxy)-N-(cyclohexylcarbamoyl)acetamide

2-(3-acetamidophenoxy)-N-(cyclohexylcarbamoyl)acetamide (PubChem CID 7698272) has the molecular formula C17H23N3O4 and a molecular weight of 333.39 g/mol. Its IUPAC name is 2-(3-acetamidophenoxy)-N-(cyclohexylcarbamoyl)acetamide.

Molecular Properties

Compound Name2-(3-acetamidophenoxy)-N-(cyclohexylcarbamoyl)acetamide
PubChem CID7698272
Molecular FormulaC17H23N3O4
Molecular Weight333.39 g/mol
Exact Mass333.17
IUPAC Name2-(3-acetamidophenoxy)-N-(cyclohexylcarbamoyl)acetamide
SMILESCC(=O)Nc1cccc(OCC(=O)NC(=O)NC2CCCCC2)c1
InChIInChI=1S/C17H23N3O4/c1-12(21)18-14-8-5-9-15(10-14)24-11-16(22)20-17(23)19-13-6-3-2-4-7-13/h5,8-10,13H,2-4,6-7,11H2,1H3,(H,18,21)(H2,19,20,22,23)
InChIKeyXTGNZUCUGBFUNH-UHFFFAOYSA-N
XLogP2.18
TPSA96.53 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.39
LogP ≤ 52.18
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(cyclohexylcarbamoyl)-2-(3-ethylphenoxy)acetamide
CID 7642586
2-[3-(cyclohexylcarbamoylamino)phenoxy]acetic acid
CID 61057844
N-(cyclohexylcarbamoyl)-2-(3,4-dimethylphenoxy)acetamide
CID 7610559
N-[3-[2-(cyclohexylamino)-2-oxoethoxy]phenyl]-2-methylpropanamide
CID 18870146
1-cyclopentyl-3-(3-ethoxyphenyl)urea
CID 47264657
2-(4-acetamidophenoxy)-N-cyclooctylacetamide
CID 112774945
2-(3-acetylphenoxy)-N-cyclohexylacetamide
CID 2708999
[3-(cycloheptylcarbamoylamino)phenyl] acetate
CID 108865301
[3-(cyclododecylcarbamoylamino)phenyl] acetate
CID 108865173
2-(3-acetamidophenoxy)-N-(1,1-dioxothiolan-3-yl)acetamide
CID 18870054
2-(4-aminophenoxy)-N-(cyclohexylcarbamoyl)acetamide
CID 61026518
N-(cyclohexylcarbamoyl)-2-(4-propan-2-ylphenoxy)acetamide
CID 7707104

Frequently Asked Questions

What is the IUPAC name of 2-(3-acetamidophenoxy)-N-(cyclohexylcarbamoyl)acetamide?
The IUPAC name of 2-(3-acetamidophenoxy)-N-(cyclohexylcarbamoyl)acetamide (CID 7698272) is 2-(3-acetamidophenoxy)-N-(cyclohexylcarbamoyl)acetamide.
What is the SMILES notation for 2-(3-acetamidophenoxy)-N-(cyclohexylcarbamoyl)acetamide?
The canonical SMILES for 2-(3-acetamidophenoxy)-N-(cyclohexylcarbamoyl)acetamide is CC(=O)Nc1cccc(OCC(=O)NC(=O)NC2CCCCC2)c1.
What is the InChIKey of 2-(3-acetamidophenoxy)-N-(cyclohexylcarbamoyl)acetamide?
The InChIKey is XTGNZUCUGBFUNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O4/c1-12(21)18-14-8-5-9-15(10-14)24-11-16(22)20-17(23)19-13-6-3-2-4-7-13/h5,8-10,13H,2-4,6-7,11H2,1H3,(H,18,21)(H2,19,20,22,23).
What are the key properties of 2-(3-acetamidophenoxy)-N-(cyclohexylcarbamoyl)acetamide?
2-(3-acetamidophenoxy)-N-(cyclohexylcarbamoyl)acetamide has a molecular weight of 333.39 g/mol, XLogP of 2.18, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-acetamidophenoxy)-N-(cyclohexylcarbamoyl)acetamide is sourced from PubChem (CID 7698272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).