N-(2-cyclopentylpyrazol-3-yl)-2-(4-ethoxyanilino)acetamide

C18H24N4O2 — CID 78815624

IUPACN-(2-cyclopentylpyrazol-3-yl)-2-(4-ethoxyanilino)acetamide
SMILESCCOc1ccc(NCC(=O)Nc2ccnn2C2CCCC2)cc1
InChIInChI=1S/C18H24N4O2/c1-2-24-16-9-7-14(8-10-16)19-13-18(23)21-17-11-12-20-22(17)15-5-3-4-6-15/h7-12,15,19H,2-6,13H2,1H3,(H,21,23)
InChIKeyMOARNEZHENYQED-UHFFFAOYSA-N
MW328.42 g/mol
LogP3.45
Rot. Bonds7

About N-(2-cyclopentylpyrazol-3-yl)-2-(4-ethoxyanilino)acetamide

N-(2-cyclopentylpyrazol-3-yl)-2-(4-ethoxyanilino)acetamide (PubChem CID 78815624) has the molecular formula C18H24N4O2 and a molecular weight of 328.42 g/mol. Its IUPAC name is N-(2-cyclopentylpyrazol-3-yl)-2-(4-ethoxyanilino)acetamide.

Molecular Properties

Compound NameN-(2-cyclopentylpyrazol-3-yl)-2-(4-ethoxyanilino)acetamide
PubChem CID78815624
Molecular FormulaC18H24N4O2
Molecular Weight328.42 g/mol
Exact Mass328.19
IUPAC NameN-(2-cyclopentylpyrazol-3-yl)-2-(4-ethoxyanilino)acetamide
SMILESCCOc1ccc(NCC(=O)Nc2ccnn2C2CCCC2)cc1
InChIInChI=1S/C18H24N4O2/c1-2-24-16-9-7-14(8-10-16)19-13-18(23)21-17-11-12-20-22(17)15-5-3-4-6-15/h7-12,15,19H,2-6,13H2,1H3,(H,21,23)
InChIKeyMOARNEZHENYQED-UHFFFAOYSA-N
XLogP3.45
TPSA68.18 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.42
LogP ≤ 53.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_C(246)', 'substructure': 'N/A'}

Analyze N-(2-cyclopentylpyrazol-3-yl)-2-(4-ethoxyanilino)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

ethyl N-(2-cyclopentylpyrazol-3-yl)carbamate
CID 110470599
N-cyclopentyl-2-(4-ethoxyanilino)acetamide
CID 28569669
2-(3-cyano-4-fluoroanilino)-N-(2-cyclopentylpyrazol-3-yl)acetamide
CID 71973351
2-(4-chloro-3-methylphenoxy)-N-(2-cyclopentylpyrazol-3-yl)acetamide
CID 38905946
ethyl 1-[2-[(2-cyclopentylpyrazol-3-yl)amino]-2-oxoethyl]piperidine-4-carboxylate
CID 8772836
N-(2-cyclohexylpyrazol-3-yl)-2-(4-nitrophenoxy)acetamide
CID 78772045
[2-[(2-cyclopentylpyrazol-3-yl)amino]-2-oxoethyl] 2-(4-propan-2-ylphenoxy)acetate
CID 8598589
[2-[(2-cyclopentylpyrazol-3-yl)amino]-2-oxoethyl] 2-phenoxyacetate
CID 7980188
[2-[(2-cyclopentylpyrazol-3-yl)amino]-2-oxoethyl] 4-(2-methylpropoxy)benzoate
CID 7194150
N-(2-cyclohexylpyrazol-3-yl)-2-(2-methylimidazol-1-yl)acetamide
CID 46997255
2-(3-chlorophenoxy)-N-(2-cyclopentylpyrazol-3-yl)acetamide
CID 35142597
2-(4-acetamidoanilino)-N-(4-ethoxyphenyl)acetamide
CID 54808313

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclopentylpyrazol-3-yl)-2-(4-ethoxyanilino)acetamide?
The IUPAC name of N-(2-cyclopentylpyrazol-3-yl)-2-(4-ethoxyanilino)acetamide (CID 78815624) is N-(2-cyclopentylpyrazol-3-yl)-2-(4-ethoxyanilino)acetamide.
What is the SMILES notation for N-(2-cyclopentylpyrazol-3-yl)-2-(4-ethoxyanilino)acetamide?
The canonical SMILES for N-(2-cyclopentylpyrazol-3-yl)-2-(4-ethoxyanilino)acetamide is CCOc1ccc(NCC(=O)Nc2ccnn2C2CCCC2)cc1.
What is the InChIKey of N-(2-cyclopentylpyrazol-3-yl)-2-(4-ethoxyanilino)acetamide?
The InChIKey is MOARNEZHENYQED-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N4O2/c1-2-24-16-9-7-14(8-10-16)19-13-18(23)21-17-11-12-20-22(17)15-5-3-4-6-15/h7-12,15,19H,2-6,13H2,1H3,(H,21,23).
What are the key properties of N-(2-cyclopentylpyrazol-3-yl)-2-(4-ethoxyanilino)acetamide?
N-(2-cyclopentylpyrazol-3-yl)-2-(4-ethoxyanilino)acetamide has a molecular weight of 328.42 g/mol, XLogP of 3.45, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclopentylpyrazol-3-yl)-2-(4-ethoxyanilino)acetamide is sourced from PubChem (CID 78815624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).