N-(cyclopentylcarbamoyl)-2-(2,4-dichlorophenoxy)acetamide

C14H16Cl2N2O3 — CID 2628000

IUPACN-(cyclopentylcarbamoyl)-2-(2,4-dichlorophenoxy)acetamide
SMILESO=C(COc1ccc(Cl)cc1Cl)NC(=O)NC1CCCC1
InChIInChI=1S/C14H16Cl2N2O3/c15-9-5-6-12(11(16)7-9)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)
InChIKeyNSELYIFATLFDOZ-UHFFFAOYSA-N
MW331.20 g/mol
LogP3.14
Rot. Bonds4

About N-(cyclopentylcarbamoyl)-2-(2,4-dichlorophenoxy)acetamide

N-(cyclopentylcarbamoyl)-2-(2,4-dichlorophenoxy)acetamide (PubChem CID 2628000) has the molecular formula C14H16Cl2N2O3 and a molecular weight of 331.20 g/mol. Its IUPAC name is N-(cyclopentylcarbamoyl)-2-(2,4-dichlorophenoxy)acetamide.

Molecular Properties

Compound NameN-(cyclopentylcarbamoyl)-2-(2,4-dichlorophenoxy)acetamide
PubChem CID2628000
Molecular FormulaC14H16Cl2N2O3
Molecular Weight331.20 g/mol
Exact Mass330.05
IUPAC NameN-(cyclopentylcarbamoyl)-2-(2,4-dichlorophenoxy)acetamide
SMILESO=C(COc1ccc(Cl)cc1Cl)NC(=O)NC1CCCC1
InChIInChI=1S/C14H16Cl2N2O3/c15-9-5-6-12(11(16)7-9)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)
InChIKeyNSELYIFATLFDOZ-UHFFFAOYSA-N
XLogP3.14
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.20
LogP ≤ 53.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(cyclopentylcarbamoyl)-2-(2,4-dichlorophenoxy)acetamide?
The IUPAC name of N-(cyclopentylcarbamoyl)-2-(2,4-dichlorophenoxy)acetamide (CID 2628000) is N-(cyclopentylcarbamoyl)-2-(2,4-dichlorophenoxy)acetamide.
What is the SMILES notation for N-(cyclopentylcarbamoyl)-2-(2,4-dichlorophenoxy)acetamide?
The canonical SMILES for N-(cyclopentylcarbamoyl)-2-(2,4-dichlorophenoxy)acetamide is O=C(COc1ccc(Cl)cc1Cl)NC(=O)NC1CCCC1.
What is the InChIKey of N-(cyclopentylcarbamoyl)-2-(2,4-dichlorophenoxy)acetamide?
The InChIKey is NSELYIFATLFDOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16Cl2N2O3/c15-9-5-6-12(11(16)7-9)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 N-(cyclopentylcarbamoyl)-2-(2,4-dichlorophenoxy)acetamide?
N-(cyclopentylcarbamoyl)-2-(2,4-dichlorophenoxy)acetamide has a molecular weight of 331.20 g/mol, XLogP of 3.14, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopentylcarbamoyl)-2-(2,4-dichlorophenoxy)acetamide is sourced from PubChem (CID 2628000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).