2-(4-aminophenyl)-N-(3-cyclopentyl-1-phenylpyrazol-5-yl)acetamide

C22H24N4O — CID 119684822

IUPAC2-(4-aminophenyl)-N-(3-cyclopentyl-1-phenylpyrazol-5-yl)acetamide
SMILESNc1ccc(CC(=O)Nc2cc(C3CCCC3)nn2-c2ccccc2)cc1
InChIInChI=1S/C22H24N4O/c23-18-12-10-16(11-13-18)14-22(27)24-21-15-20(17-6-4-5-7-17)25-26(21)19-8-2-1-3-9-19/h1-3,8-13,15,17H,4-7,14,23H2,(H,24,27)
InChIKeyMZVGYKSPJYIMMN-UHFFFAOYSA-N
MW360.46 g/mol
LogP4.29
Rot. Bonds5

About 2-(4-aminophenyl)-N-(3-cyclopentyl-1-phenylpyrazol-5-yl)acetamide

2-(4-aminophenyl)-N-(3-cyclopentyl-1-phenylpyrazol-5-yl)acetamide (PubChem CID 119684822) has the molecular formula C22H24N4O and a molecular weight of 360.46 g/mol. Its IUPAC name is 2-(4-aminophenyl)-N-(3-cyclopentyl-1-phenylpyrazol-5-yl)acetamide.

Molecular Properties

Compound Name2-(4-aminophenyl)-N-(3-cyclopentyl-1-phenylpyrazol-5-yl)acetamide
PubChem CID119684822
Molecular FormulaC22H24N4O
Molecular Weight360.46 g/mol
Exact Mass360.20
IUPAC Name2-(4-aminophenyl)-N-(3-cyclopentyl-1-phenylpyrazol-5-yl)acetamide
SMILESNc1ccc(CC(=O)Nc2cc(C3CCCC3)nn2-c2ccccc2)cc1
InChIInChI=1S/C22H24N4O/c23-18-12-10-16(11-13-18)14-22(27)24-21-15-20(17-6-4-5-7-17)25-26(21)19-8-2-1-3-9-19/h1-3,8-13,15,17H,4-7,14,23H2,(H,24,27)
InChIKeyMZVGYKSPJYIMMN-UHFFFAOYSA-N
XLogP4.29
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.46
LogP ≤ 54.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_no_alk(40)', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

2-amino-N-(3-cyclopentyl-1-phenylpyrazol-5-yl)acetamide;hydrochloride
CID 119268734
2-chloro-N-(3-cyclopropyl-1-phenylpyrazol-5-yl)acetamide
CID 2778369
N-(3-cyclopentyl-1-methylpyrazol-5-yl)-2-phenylacetamide
CID 134799695
4-amino-N-(3-cyclopentyl-1-phenylpyrazol-5-yl)-3-methoxybutanamide
CID 120586999
N-(3-cyclopentyl-1-phenylpyrazol-5-yl)-3-propan-2-yloxypropanamide
CID 112819311
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(3-cyclopentyl-1-phenylpyrazol-5-yl)acetamide;hydrochloride
CID 119684833
3-acetamido-N-(3-cyclopentyl-1-phenylpyrazol-5-yl)-3-phenylpropanamide
CID 78830466
N-(3-cyclopentyl-1-phenylpyrazol-5-yl)-2-(6,8-dioxo-5,7-diazaspiro[3.4]octan-7-yl)acetamide
CID 56520964
N-(3-cyclopentyl-1-phenylpyrazol-5-yl)-2-[4-[(S)-hydroxy(phenyl)methyl]piperidin-1-yl]acetamide
CID 36672610
4-[[[2-[(3-cyclopentyl-1-phenylpyrazol-5-yl)amino]-2-oxoethyl]-methylamino]methyl]-N-cyclopropylbenzamide
CID 34626707
2-(3-benzyl-2,6-dioxopyrimidin-1-yl)-N-(3-cyclopentyl-1-phenylpyrazol-5-yl)acetamide
CID 112805680
phenyl N-(3-cyclobutyl-1-phenylpyrazol-5-yl)carbamate
CID 66876742

Frequently Asked Questions

What is the IUPAC name of 2-(4-aminophenyl)-N-(3-cyclopentyl-1-phenylpyrazol-5-yl)acetamide?
The IUPAC name of 2-(4-aminophenyl)-N-(3-cyclopentyl-1-phenylpyrazol-5-yl)acetamide (CID 119684822) is 2-(4-aminophenyl)-N-(3-cyclopentyl-1-phenylpyrazol-5-yl)acetamide.
What is the SMILES notation for 2-(4-aminophenyl)-N-(3-cyclopentyl-1-phenylpyrazol-5-yl)acetamide?
The canonical SMILES for 2-(4-aminophenyl)-N-(3-cyclopentyl-1-phenylpyrazol-5-yl)acetamide is Nc1ccc(CC(=O)Nc2cc(C3CCCC3)nn2-c2ccccc2)cc1.
What is the InChIKey of 2-(4-aminophenyl)-N-(3-cyclopentyl-1-phenylpyrazol-5-yl)acetamide?
The InChIKey is MZVGYKSPJYIMMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N4O/c23-18-12-10-16(11-13-18)14-22(27)24-21-15-20(17-6-4-5-7-17)25-26(21)19-8-2-1-3-9-19/h1-3,8-13,15,17H,4-7,14,23H2,(H,24,27).
What are the key properties of 2-(4-aminophenyl)-N-(3-cyclopentyl-1-phenylpyrazol-5-yl)acetamide?
2-(4-aminophenyl)-N-(3-cyclopentyl-1-phenylpyrazol-5-yl)acetamide has a molecular weight of 360.46 g/mol, XLogP of 4.29, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-aminophenyl)-N-(3-cyclopentyl-1-phenylpyrazol-5-yl)acetamide is sourced from PubChem (CID 119684822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).