2-(3-tert-butylpyrazol-1-yl)-N-(4-methoxyphenyl)acetamide

C16H21N3O2 — CID 122142305

IUPAC2-(3-tert-butylpyrazol-1-yl)-N-(4-methoxyphenyl)acetamide
SMILESCOc1ccc(NC(=O)Cn2ccc(C(C)(C)C)n2)cc1
InChIInChI=1S/C16H21N3O2/c1-16(2,3)14-9-10-19(18-14)11-15(20)17-12-5-7-13(21-4)8-6-12/h5-10H,11H2,1-4H3,(H,17,20)
InChIKeyODJWBDIMBCBTGI-UHFFFAOYSA-N
MW287.36 g/mol
LogP2.83
Rot. Bonds4

About 2-(3-tert-butylpyrazol-1-yl)-N-(4-methoxyphenyl)acetamide

2-(3-tert-butylpyrazol-1-yl)-N-(4-methoxyphenyl)acetamide (PubChem CID 122142305) has the molecular formula C16H21N3O2 and a molecular weight of 287.36 g/mol. Its IUPAC name is 2-(3-tert-butylpyrazol-1-yl)-N-(4-methoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(3-tert-butylpyrazol-1-yl)-N-(4-methoxyphenyl)acetamide
PubChem CID122142305
Molecular FormulaC16H21N3O2
Molecular Weight287.36 g/mol
Exact Mass287.16
IUPAC Name2-(3-tert-butylpyrazol-1-yl)-N-(4-methoxyphenyl)acetamide
SMILESCOc1ccc(NC(=O)Cn2ccc(C(C)(C)C)n2)cc1
InChIInChI=1S/C16H21N3O2/c1-16(2,3)14-9-10-19(18-14)11-15(20)17-12-5-7-13(21-4)8-6-12/h5-10H,11H2,1-4H3,(H,17,20)
InChIKeyODJWBDIMBCBTGI-UHFFFAOYSA-N
XLogP2.83
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.36
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-(3-tert-butylpyrazol-1-yl)-N-(4-methoxyphenyl)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

2-(3-aminopyrazol-1-yl)-N-(4-methoxyphenyl)acetamide
CID 55024845
N-(3,5-dimethoxyphenyl)-2-[3-(trifluoromethyl)pyrazol-1-yl]acetamide
CID 9096694
2-(3-amino-1,2,4-triazol-1-yl)-N-(4-methoxyphenyl)acetamide
CID 60911192
N-(4-phenoxyphenyl)-2-[3-(trifluoromethyl)pyrazol-1-yl]acetamide
CID 2505978
N-(4-methoxyphenyl)-2-(2-methylimidazol-1-yl)acetamide
CID 55028374
N'-[1-(4-methoxyphenyl)ethenyl]-2-[3-(trifluoromethyl)pyrazol-1-yl]acetohydrazide
CID 2351774
N,N-dimethyl-4-[[2-[3-(trifluoromethyl)pyrazol-1-yl]acetyl]amino]benzamide
CID 38107131
N-(4-methoxyphenyl)-2-(6-oxopyrimidin-1-yl)acetamide
CID 115679434
2-[4-(1-hydroxyethyl)triazol-1-yl]-N-(4-methoxyphenyl)acetamide
CID 80742697
2-[1-[2-(4-methoxyanilino)-2-oxoethyl]triazol-4-yl]acetic acid
CID 107461336
1-methyl-N-[4-[[2-[3-(trifluoromethyl)pyrazol-1-yl]acetyl]amino]phenyl]pyrazole-3-carboxamide
CID 19530968
2-(4-bromo-3-nitropyrazol-1-yl)-N-(4-methoxyphenyl)acetamide
CID 1076666

Frequently Asked Questions

What is the IUPAC name of 2-(3-tert-butylpyrazol-1-yl)-N-(4-methoxyphenyl)acetamide?
The IUPAC name of 2-(3-tert-butylpyrazol-1-yl)-N-(4-methoxyphenyl)acetamide (CID 122142305) is 2-(3-tert-butylpyrazol-1-yl)-N-(4-methoxyphenyl)acetamide.
What is the SMILES notation for 2-(3-tert-butylpyrazol-1-yl)-N-(4-methoxyphenyl)acetamide?
The canonical SMILES for 2-(3-tert-butylpyrazol-1-yl)-N-(4-methoxyphenyl)acetamide is COc1ccc(NC(=O)Cn2ccc(C(C)(C)C)n2)cc1.
What is the InChIKey of 2-(3-tert-butylpyrazol-1-yl)-N-(4-methoxyphenyl)acetamide?
The InChIKey is ODJWBDIMBCBTGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O2/c1-16(2,3)14-9-10-19(18-14)11-15(20)17-12-5-7-13(21-4)8-6-12/h5-10H,11H2,1-4H3,(H,17,20).
What are the key properties of 2-(3-tert-butylpyrazol-1-yl)-N-(4-methoxyphenyl)acetamide?
2-(3-tert-butylpyrazol-1-yl)-N-(4-methoxyphenyl)acetamide has a molecular weight of 287.36 g/mol, XLogP of 2.83, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-tert-butylpyrazol-1-yl)-N-(4-methoxyphenyl)acetamide is sourced from PubChem (CID 122142305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).