N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-(3-methoxy-4-methylphenyl)acetamide

C15H19N3O2 — CID 43402634

IUPACN-(3,5-dimethyl-1H-pyrazol-4-yl)-2-(3-methoxy-4-methylphenyl)acetamide
SMILESCOc1cc(CC(=O)Nc2c(C)n[nH]c2C)ccc1C
InChIInChI=1S/C15H19N3O2/c1-9-5-6-12(7-13(9)20-4)8-14(19)16-15-10(2)17-18-11(15)3/h5-7H,8H2,1-4H3,(H,16,19)(H,17,18)
InChIKeyHTYPUWREDWZXHT-UHFFFAOYSA-N
MW273.34 g/mol
LogP2.52
Rot. Bonds4

About N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-(3-methoxy-4-methylphenyl)acetamide

N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-(3-methoxy-4-methylphenyl)acetamide (PubChem CID 43402634) has the molecular formula C15H19N3O2 and a molecular weight of 273.34 g/mol. Its IUPAC name is N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-(3-methoxy-4-methylphenyl)acetamide.

Molecular Properties

Compound NameN-(3,5-dimethyl-1H-pyrazol-4-yl)-2-(3-methoxy-4-methylphenyl)acetamide
PubChem CID43402634
Molecular FormulaC15H19N3O2
Molecular Weight273.34 g/mol
Exact Mass273.15
IUPAC NameN-(3,5-dimethyl-1H-pyrazol-4-yl)-2-(3-methoxy-4-methylphenyl)acetamide
SMILESCOc1cc(CC(=O)Nc2c(C)n[nH]c2C)ccc1C
InChIInChI=1S/C15H19N3O2/c1-9-5-6-12(7-13(9)20-4)8-14(19)16-15-10(2)17-18-11(15)3/h5-7H,8H2,1-4H3,(H,16,19)(H,17,18)
InChIKeyHTYPUWREDWZXHT-UHFFFAOYSA-N
XLogP2.52
TPSA67.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 52.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-bromo-4-fluorophenyl)-N-(3,5-dimethyl-1H-pyrazol-4-yl)acetamide
CID 122158377
2-(3-methoxy-4-methylphenyl)-N-(1H-pyrazol-5-yl)acetamide
CID 61393750
N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-(1H-indol-6-yl)acetamide
CID 112525224
N-(5,6-dimethylpyridazin-3-yl)-2-(3-methoxy-4-methylphenyl)acetamide
CID 136525992
N-[3-(2,5-dimethoxyphenyl)-5-methyl-1H-pyrazol-4-yl]-2-(4-methoxyphenyl)acetamide
CID 42685763
2-(2,2-difluoro-1,3-benzodioxol-5-yl)-N-(3,5-dimethyl-1H-pyrazol-4-yl)acetamide
CID 136549867
2-(3-methoxy-4-methylphenyl)-N-(4-methoxy-3-methylphenyl)acetamide
CID 87032377
N-[3-(2,4-dimethylphenyl)-5-methyl-1H-pyrazol-4-yl]-2-(4-methoxyphenyl)acetamide
CID 42874069
2-(3-methoxy-4-methylphenyl)-N-(1-methylpyrazol-3-yl)acetamide
CID 16622145
3-(2,4-dimethylphenoxy)-N-(3,5-dimethyl-1H-pyrazol-4-yl)propanamide
CID 43546863
2-(3-methoxyphenyl)-N-[3-[2-(4-methoxyphenyl)ethyl]-5-methyl-1H-pyrazol-4-yl]acetamide
CID 42686366
4-[[(3,5-dimethyl-1H-pyrazol-4-yl)amino]methyl]-2,6-dimethoxyphenol
CID 43547176

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-(3-methoxy-4-methylphenyl)acetamide?
The IUPAC name of N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-(3-methoxy-4-methylphenyl)acetamide (CID 43402634) is N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-(3-methoxy-4-methylphenyl)acetamide.
What is the SMILES notation for N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-(3-methoxy-4-methylphenyl)acetamide?
The canonical SMILES for N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-(3-methoxy-4-methylphenyl)acetamide is COc1cc(CC(=O)Nc2c(C)n[nH]c2C)ccc1C.
What is the InChIKey of N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-(3-methoxy-4-methylphenyl)acetamide?
The InChIKey is HTYPUWREDWZXHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2/c1-9-5-6-12(7-13(9)20-4)8-14(19)16-15-10(2)17-18-11(15)3/h5-7H,8H2,1-4H3,(H,16,19)(H,17,18).
What are the key properties of N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-(3-methoxy-4-methylphenyl)acetamide?
N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-(3-methoxy-4-methylphenyl)acetamide has a molecular weight of 273.34 g/mol, XLogP of 2.52, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-(3-methoxy-4-methylphenyl)acetamide is sourced from PubChem (CID 43402634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).