2-(3-chlorophenoxy)-N-(2-cyclopentylpyrazol-3-yl)acetamide

C16H18ClN3O2 — CID 35142597

IUPAC2-(3-chlorophenoxy)-N-(2-cyclopentylpyrazol-3-yl)acetamide
SMILESO=C(COc1cccc(Cl)c1)Nc1ccnn1C1CCCC1
InChIInChI=1S/C16H18ClN3O2/c17-12-4-3-7-14(10-12)22-11-16(21)19-15-8-9-18-20(15)13-5-1-2-6-13/h3-4,7-10,13H,1-2,5-6,11H2,(H,19,21)
InChIKeyXSFZIPSMWGEHCA-UHFFFAOYSA-N
MW319.79 g/mol
LogP3.67
Rot. Bonds5

About 2-(3-chlorophenoxy)-N-(2-cyclopentylpyrazol-3-yl)acetamide

2-(3-chlorophenoxy)-N-(2-cyclopentylpyrazol-3-yl)acetamide (PubChem CID 35142597) has the molecular formula C16H18ClN3O2 and a molecular weight of 319.79 g/mol. Its IUPAC name is 2-(3-chlorophenoxy)-N-(2-cyclopentylpyrazol-3-yl)acetamide.

Molecular Properties

Compound Name2-(3-chlorophenoxy)-N-(2-cyclopentylpyrazol-3-yl)acetamide
PubChem CID35142597
Molecular FormulaC16H18ClN3O2
Molecular Weight319.79 g/mol
Exact Mass319.11
IUPAC Name2-(3-chlorophenoxy)-N-(2-cyclopentylpyrazol-3-yl)acetamide
SMILESO=C(COc1cccc(Cl)c1)Nc1ccnn1C1CCCC1
InChIInChI=1S/C16H18ClN3O2/c17-12-4-3-7-14(10-12)22-11-16(21)19-15-8-9-18-20(15)13-5-1-2-6-13/h3-4,7-10,13H,1-2,5-6,11H2,(H,19,21)
InChIKeyXSFZIPSMWGEHCA-UHFFFAOYSA-N
XLogP3.67
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.79
LogP ≤ 53.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-chloro-3-methylphenoxy)-N-(2-cyclopentylpyrazol-3-yl)acetamide
CID 38905946
2-(2-chlorophenoxy)-N-(2-cyclohexylpyrazol-3-yl)acetamide
CID 51145877
[2-[(2-cyclopentylpyrazol-3-yl)amino]-2-oxoethyl] 2-phenoxyacetate
CID 7980188
2-[(3-chlorophenyl)methylsulfanyl]-N-(2-cyclopentylpyrazol-3-yl)acetamide
CID 112763552
N-(2-cyclohexylpyrazol-3-yl)-2-(4-nitrophenoxy)acetamide
CID 78772045
[2-[(2-cyclopentylpyrazol-3-yl)amino]-2-oxoethyl] 3-methoxybenzoate
CID 7985867
N-[2-[(2R)-butan-2-yl]pyrazol-3-yl]-2-(3-chlorophenoxy)acetamide
CID 42387509
[2-[(2-cyclopentylpyrazol-3-yl)amino]-2-oxoethyl] 2-(4-propan-2-ylphenoxy)acetate
CID 8598589
2-chloro-N-(2-cyclobutylpyrazol-3-yl)acetamide
CID 166407634
2-(4-chlorophenyl)sulfanyl-N-(2-cyclopentylpyrazol-3-yl)acetamide
CID 7816349
2-(2-chloro-6-fluorophenyl)-N-(2-cyclopentylpyrazol-3-yl)acetamide
CID 8819868
N-(2-cyclopentylpyrazol-3-yl)-2-(4-ethoxyanilino)acetamide
CID 78815624

Frequently Asked Questions

What is the IUPAC name of 2-(3-chlorophenoxy)-N-(2-cyclopentylpyrazol-3-yl)acetamide?
The IUPAC name of 2-(3-chlorophenoxy)-N-(2-cyclopentylpyrazol-3-yl)acetamide (CID 35142597) is 2-(3-chlorophenoxy)-N-(2-cyclopentylpyrazol-3-yl)acetamide.
What is the SMILES notation for 2-(3-chlorophenoxy)-N-(2-cyclopentylpyrazol-3-yl)acetamide?
The canonical SMILES for 2-(3-chlorophenoxy)-N-(2-cyclopentylpyrazol-3-yl)acetamide is O=C(COc1cccc(Cl)c1)Nc1ccnn1C1CCCC1.
What is the InChIKey of 2-(3-chlorophenoxy)-N-(2-cyclopentylpyrazol-3-yl)acetamide?
The InChIKey is XSFZIPSMWGEHCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18ClN3O2/c17-12-4-3-7-14(10-12)22-11-16(21)19-15-8-9-18-20(15)13-5-1-2-6-13/h3-4,7-10,13H,1-2,5-6,11H2,(H,19,21).
What are the key properties of 2-(3-chlorophenoxy)-N-(2-cyclopentylpyrazol-3-yl)acetamide?
2-(3-chlorophenoxy)-N-(2-cyclopentylpyrazol-3-yl)acetamide has a molecular weight of 319.79 g/mol, XLogP of 3.67, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chlorophenoxy)-N-(2-cyclopentylpyrazol-3-yl)acetamide is sourced from PubChem (CID 35142597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).