2-(2-acetyl-4-chlorophenoxy)-N-(cyclopropylcarbamoyl)acetamide

C14H15ClN2O4 — CID 7167631

IUPAC2-(2-acetyl-4-chlorophenoxy)-N-(cyclopropylcarbamoyl)acetamide
SMILESCC(=O)c1cc(Cl)ccc1OCC(=O)NC(=O)NC1CC1
InChIInChI=1S/C14H15ClN2O4/c1-8(18)11-6-9(15)2-5-12(11)21-7-13(19)17-14(20)16-10-3-4-10/h2,5-6,10H,3-4,7H2,1H3,(H2,16,17,19,20)
InChIKeyZDZXIWNVRZUJMJ-UHFFFAOYSA-N
MW310.74 g/mol
LogP1.91
Rot. Bonds5

About 2-(2-acetyl-4-chlorophenoxy)-N-(cyclopropylcarbamoyl)acetamide

2-(2-acetyl-4-chlorophenoxy)-N-(cyclopropylcarbamoyl)acetamide (PubChem CID 7167631) has the molecular formula C14H15ClN2O4 and a molecular weight of 310.74 g/mol. Its IUPAC name is 2-(2-acetyl-4-chlorophenoxy)-N-(cyclopropylcarbamoyl)acetamide.

Molecular Properties

Compound Name2-(2-acetyl-4-chlorophenoxy)-N-(cyclopropylcarbamoyl)acetamide
PubChem CID7167631
Molecular FormulaC14H15ClN2O4
Molecular Weight310.74 g/mol
Exact Mass310.07
IUPAC Name2-(2-acetyl-4-chlorophenoxy)-N-(cyclopropylcarbamoyl)acetamide
SMILESCC(=O)c1cc(Cl)ccc1OCC(=O)NC(=O)NC1CC1
InChIInChI=1S/C14H15ClN2O4/c1-8(18)11-6-9(15)2-5-12(11)21-7-13(19)17-14(20)16-10-3-4-10/h2,5-6,10H,3-4,7H2,1H3,(H2,16,17,19,20)
InChIKeyZDZXIWNVRZUJMJ-UHFFFAOYSA-N
XLogP1.91
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.74
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-acetyl-4-fluorophenoxy)-N-(cyclohexylcarbamoyl)acetamide
CID 112774564
3-(2-acetyl-4-chlorophenoxy)-N-cyclopropylpropanamide
CID 62628472
[2-(cyclopropylcarbamoylamino)-2-oxoethyl] 5-chloro-2-methoxybenzoate
CID 7581872
2-(2-acetyl-4-chlorophenoxy)-N-[(2-fluorophenyl)carbamoyl]acetamide
CID 7167689
[2-(cyclopentylcarbamoylamino)-2-oxoethyl] 5-chloro-2-fluorobenzoate
CID 8620254
[2-(cyclopropylcarbamoylamino)-2-oxoethyl] (2R)-2-(2,4-dichlorophenoxy)propanoate
CID 7862297
[2-(cyclopropylcarbamoylamino)-2-oxoethyl] 4-(4-chloro-2-methylphenoxy)butanoate
CID 7868590
2-(2-acetyl-4-chlorophenoxy)-N-[(2R)-butan-2-yl]acetamide
CID 7167702
2-(2-acetyl-4-fluorophenoxy)-N-(4-methylcyclohexyl)acetamide
CID 4794961
N-(cyclohexylcarbamoyl)-2-(2,4-dimethylphenoxy)acetamide
CID 7706804
5-chloro-2-[2-(cyclohexylamino)-2-oxoethoxy]-N-phenylbenzamide
CID 7893364
2-(2-acetyl-4-chlorophenoxy)-N-(3,4-dimethylphenyl)acetamide
CID 7167750

Frequently Asked Questions

What is the IUPAC name of 2-(2-acetyl-4-chlorophenoxy)-N-(cyclopropylcarbamoyl)acetamide?
The IUPAC name of 2-(2-acetyl-4-chlorophenoxy)-N-(cyclopropylcarbamoyl)acetamide (CID 7167631) is 2-(2-acetyl-4-chlorophenoxy)-N-(cyclopropylcarbamoyl)acetamide.
What is the SMILES notation for 2-(2-acetyl-4-chlorophenoxy)-N-(cyclopropylcarbamoyl)acetamide?
The canonical SMILES for 2-(2-acetyl-4-chlorophenoxy)-N-(cyclopropylcarbamoyl)acetamide is CC(=O)c1cc(Cl)ccc1OCC(=O)NC(=O)NC1CC1.
What is the InChIKey of 2-(2-acetyl-4-chlorophenoxy)-N-(cyclopropylcarbamoyl)acetamide?
The InChIKey is ZDZXIWNVRZUJMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15ClN2O4/c1-8(18)11-6-9(15)2-5-12(11)21-7-13(19)17-14(20)16-10-3-4-10/h2,5-6,10H,3-4,7H2,1H3,(H2,16,17,19,20).
What are the key properties of 2-(2-acetyl-4-chlorophenoxy)-N-(cyclopropylcarbamoyl)acetamide?
2-(2-acetyl-4-chlorophenoxy)-N-(cyclopropylcarbamoyl)acetamide has a molecular weight of 310.74 g/mol, XLogP of 1.91, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-acetyl-4-chlorophenoxy)-N-(cyclopropylcarbamoyl)acetamide is sourced from PubChem (CID 7167631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).