2-(2-bromo-4-chlorophenoxy)-N-(cyclopentylcarbamoyl)acetamide

C14H16BrClN2O3 — CID 4313650

IUPAC2-(2-bromo-4-chlorophenoxy)-N-(cyclopentylcarbamoyl)acetamide
SMILESO=C(COc1ccc(Cl)cc1Br)NC(=O)NC1CCCC1
InChIInChI=1S/C14H16BrClN2O3/c15-11-7-9(16)5-6-12(11)21-8-13(19)18-14(20)17-10-3-1-2-4-10/h5-7,10H,1-4,8H2,(H2,17,18,19,20)
InChIKeyTVZQWCJFKBONFQ-UHFFFAOYSA-N
MW375.65 g/mol
LogP3.25
Rot. Bonds4

About 2-(2-bromo-4-chlorophenoxy)-N-(cyclopentylcarbamoyl)acetamide

2-(2-bromo-4-chlorophenoxy)-N-(cyclopentylcarbamoyl)acetamide (PubChem CID 4313650) has the molecular formula C14H16BrClN2O3 and a molecular weight of 375.65 g/mol. Its IUPAC name is 2-(2-bromo-4-chlorophenoxy)-N-(cyclopentylcarbamoyl)acetamide.

Molecular Properties

Compound Name2-(2-bromo-4-chlorophenoxy)-N-(cyclopentylcarbamoyl)acetamide
PubChem CID4313650
Molecular FormulaC14H16BrClN2O3
Molecular Weight375.65 g/mol
Exact Mass374.00
IUPAC Name2-(2-bromo-4-chlorophenoxy)-N-(cyclopentylcarbamoyl)acetamide
SMILESO=C(COc1ccc(Cl)cc1Br)NC(=O)NC1CCCC1
InChIInChI=1S/C14H16BrClN2O3/c15-11-7-9(16)5-6-12(11)21-8-13(19)18-14(20)17-10-3-1-2-4-10/h5-7,10H,1-4,8H2,(H2,17,18,19,20)
InChIKeyTVZQWCJFKBONFQ-UHFFFAOYSA-N
XLogP3.25
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.65
LogP ≤ 53.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-(2-bromo-4-chlorophenoxy)-N-(cyclopentylcarbamoyl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(2-bromophenoxy)-N-cyclopentylacetamide
CID 729424
N-(benzylcarbamoyl)-2-(2-bromo-4-chlorophenoxy)acetamide
CID 2627425
N-(cyclopentylcarbamoyl)-2-(2,4-dichlorophenoxy)acetamide
CID 2628000
N-(cyclopentylcarbamoyl)-2-(2,4-dibromophenoxy)acetamide
CID 2632678
2-(4-bromo-2-chlorophenoxy)-N-(cyclopentylcarbamoyl)acetamide
CID 3882773
2-(2-bromophenoxy)-N-(cyclopentylcarbamoyl)acetamide
CID 7847650
2-(2-bromo-4-chlorophenoxy)-N-cyclopropylacetamide
CID 2563098
[2-(Cyclopropylamino)-2-oxoethyl] 2-(2-bromo-4-chlorophenoxy)acetate
CID 3987952
2-(2-bromo-4-chlorophenoxy)-N-cyclohexyl-N-methylacetamide
CID 1226773
2-(2-chlorophenoxy)-N-(cyclopentylcarbamoyl)acetamide
CID 2631946
[2-(Cycloheptylamino)-2-oxoethyl] 2-(2-bromo-4-chlorophenoxy)acetate
CID 3970402
2-(3-chloro-4-fluorophenoxy)-N-(cyclopentylcarbamoyl)acetamide
CID 2641654

Frequently Asked Questions

What is the IUPAC name of 2-(2-bromo-4-chlorophenoxy)-N-(cyclopentylcarbamoyl)acetamide?
The IUPAC name of 2-(2-bromo-4-chlorophenoxy)-N-(cyclopentylcarbamoyl)acetamide (CID 4313650) is 2-(2-bromo-4-chlorophenoxy)-N-(cyclopentylcarbamoyl)acetamide.
What is the SMILES notation for 2-(2-bromo-4-chlorophenoxy)-N-(cyclopentylcarbamoyl)acetamide?
The canonical SMILES for 2-(2-bromo-4-chlorophenoxy)-N-(cyclopentylcarbamoyl)acetamide is O=C(COc1ccc(Cl)cc1Br)NC(=O)NC1CCCC1.
What is the InChIKey of 2-(2-bromo-4-chlorophenoxy)-N-(cyclopentylcarbamoyl)acetamide?
The InChIKey is TVZQWCJFKBONFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16BrClN2O3/c15-11-7-9(16)5-6-12(11)21-8-13(19)18-14(20)17-10-3-1-2-4-10/h5-7,10H,1-4,8H2,(H2,17,18,19,20).
What are the key properties of 2-(2-bromo-4-chlorophenoxy)-N-(cyclopentylcarbamoyl)acetamide?
2-(2-bromo-4-chlorophenoxy)-N-(cyclopentylcarbamoyl)acetamide has a molecular weight of 375.65 g/mol, XLogP of 3.25, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-bromo-4-chlorophenoxy)-N-(cyclopentylcarbamoyl)acetamide is sourced from PubChem (CID 4313650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).