2-[4-(2-aminophenyl)pyrazol-1-yl]-N-cyclopropyl-N-ethylacetamide

C16H20N4O — CID 63338520

IUPAC2-[4-(2-aminophenyl)pyrazol-1-yl]-N-cyclopropyl-N-ethylacetamide
SMILESCCN(C(=O)Cn1cc(-c2ccccc2N)cn1)C1CC1
InChIInChI=1S/C16H20N4O/c1-2-20(13-7-8-13)16(21)11-19-10-12(9-18-19)14-5-3-4-6-15(14)17/h3-6,9-10,13H,2,7-8,11,17H2,1H3
InChIKeyHUCBSNNGFYJAGK-UHFFFAOYSA-N
MW284.36 g/mol
LogP2.14
Rot. Bonds5

About 2-[4-(2-aminophenyl)pyrazol-1-yl]-N-cyclopropyl-N-ethylacetamide

2-[4-(2-aminophenyl)pyrazol-1-yl]-N-cyclopropyl-N-ethylacetamide (PubChem CID 63338520) has the molecular formula C16H20N4O and a molecular weight of 284.36 g/mol. Its IUPAC name is 2-[4-(2-aminophenyl)pyrazol-1-yl]-N-cyclopropyl-N-ethylacetamide.

Molecular Properties

Compound Name2-[4-(2-aminophenyl)pyrazol-1-yl]-N-cyclopropyl-N-ethylacetamide
PubChem CID63338520
Molecular FormulaC16H20N4O
Molecular Weight284.36 g/mol
Exact Mass284.16
IUPAC Name2-[4-(2-aminophenyl)pyrazol-1-yl]-N-cyclopropyl-N-ethylacetamide
SMILESCCN(C(=O)Cn1cc(-c2ccccc2N)cn1)C1CC1
InChIInChI=1S/C16H20N4O/c1-2-20(13-7-8-13)16(21)11-19-10-12(9-18-19)14-5-3-4-6-15(14)17/h3-6,9-10,13H,2,7-8,11,17H2,1H3
InChIKeyHUCBSNNGFYJAGK-UHFFFAOYSA-N
XLogP2.14
TPSA64.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

2-(4-aminopyrazol-1-yl)-N-cyclopropyl-N-ethylacetamide
CID 43445485
4-[4-(2-aminophenyl)pyrazol-1-yl]-N,N-dimethylbutanamide
CID 63338474
2-(4-aminopyrazol-1-yl)-N-cyclopropyl-N-propylacetamide
CID 43445497
3-[4-(2-aminophenyl)pyrazol-1-yl]-2,2-dimethylpropanoic acid
CID 79624811
2-[4-(2-aminophenyl)pyrazol-1-yl]-N-ethylpropanamide
CID 63338077
2-[4-(2-aminophenyl)pyrazol-1-yl]-N-(3-tert-butyl-1-methylpyrazol-5-yl)acetamide
CID 46984542
1-cyclopropyl-2-(4-phenylpyrazol-1-yl)ethanone
CID 63912454
2-[1-(3-ethylsulfanylpropyl)pyrazol-4-yl]aniline
CID 113473561
2-(1-benzylpyrazol-4-yl)aniline
CID 63338467
2-(3-carbamothioyl-1,2,4-triazol-1-yl)-N-cyclopropyl-N-ethylacetamide
CID 62950723
2-(7-amino-2,3-dihydroindol-1-yl)-N-cyclopropyl-N-ethylacetamide
CID 114456129
2-[4-(2-phenylphenyl)pyrazol-1-yl]acetamide
CID 121499014

Frequently Asked Questions

What is the IUPAC name of 2-[4-(2-aminophenyl)pyrazol-1-yl]-N-cyclopropyl-N-ethylacetamide?
The IUPAC name of 2-[4-(2-aminophenyl)pyrazol-1-yl]-N-cyclopropyl-N-ethylacetamide (CID 63338520) is 2-[4-(2-aminophenyl)pyrazol-1-yl]-N-cyclopropyl-N-ethylacetamide.
What is the SMILES notation for 2-[4-(2-aminophenyl)pyrazol-1-yl]-N-cyclopropyl-N-ethylacetamide?
The canonical SMILES for 2-[4-(2-aminophenyl)pyrazol-1-yl]-N-cyclopropyl-N-ethylacetamide is CCN(C(=O)Cn1cc(-c2ccccc2N)cn1)C1CC1.
What is the InChIKey of 2-[4-(2-aminophenyl)pyrazol-1-yl]-N-cyclopropyl-N-ethylacetamide?
The InChIKey is HUCBSNNGFYJAGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O/c1-2-20(13-7-8-13)16(21)11-19-10-12(9-18-19)14-5-3-4-6-15(14)17/h3-6,9-10,13H,2,7-8,11,17H2,1H3.
What are the key properties of 2-[4-(2-aminophenyl)pyrazol-1-yl]-N-cyclopropyl-N-ethylacetamide?
2-[4-(2-aminophenyl)pyrazol-1-yl]-N-cyclopropyl-N-ethylacetamide has a molecular weight of 284.36 g/mol, XLogP of 2.14, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2-aminophenyl)pyrazol-1-yl]-N-cyclopropyl-N-ethylacetamide is sourced from PubChem (CID 63338520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).