N-[5-methyl-4-(3-methylphenyl)-1H-pyrazol-3-yl]-2-(3-methylphenyl)acetamide

C20H21N3O — CID 53197836

IUPACN-[5-methyl-4-(3-methylphenyl)-1H-pyrazol-3-yl]-2-(3-methylphenyl)acetamide
SMILESCc1cccc(CC(=O)Nc2n[nH]c(C)c2-c2cccc(C)c2)c1
InChIInChI=1S/C20H21N3O/c1-13-6-4-8-16(10-13)12-18(24)21-20-19(15(3)22-23-20)17-9-5-7-14(2)11-17/h4-11H,12H2,1-3H3,(H2,21,22,23,24)
InChIKeyRSKONEBZUKDEHE-UHFFFAOYSA-N
MW319.41 g/mol
LogP4.18
Rot. Bonds4

About N-[5-methyl-4-(3-methylphenyl)-1H-pyrazol-3-yl]-2-(3-methylphenyl)acetamide

N-[5-methyl-4-(3-methylphenyl)-1H-pyrazol-3-yl]-2-(3-methylphenyl)acetamide (PubChem CID 53197836) has the molecular formula C20H21N3O and a molecular weight of 319.41 g/mol. Its IUPAC name is N-[5-methyl-4-(3-methylphenyl)-1H-pyrazol-3-yl]-2-(3-methylphenyl)acetamide.

Molecular Properties

Compound NameN-[5-methyl-4-(3-methylphenyl)-1H-pyrazol-3-yl]-2-(3-methylphenyl)acetamide
PubChem CID53197836
Molecular FormulaC20H21N3O
Molecular Weight319.41 g/mol
Exact Mass319.17
IUPAC NameN-[5-methyl-4-(3-methylphenyl)-1H-pyrazol-3-yl]-2-(3-methylphenyl)acetamide
SMILESCc1cccc(CC(=O)Nc2n[nH]c(C)c2-c2cccc(C)c2)c1
InChIInChI=1S/C20H21N3O/c1-13-6-4-8-16(10-13)12-18(24)21-20-19(15(3)22-23-20)17-9-5-7-14(2)11-17/h4-11H,12H2,1-3H3,(H2,21,22,23,24)
InChIKeyRSKONEBZUKDEHE-UHFFFAOYSA-N
XLogP4.18
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.41
LogP ≤ 54.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[4-(3-chlorophenyl)-5-methyl-1H-pyrazol-3-yl]-2-(4-hydroxyphenyl)acetamide
CID 75426614
N-(1H-indazol-3-yl)-2-(3-methylphenyl)acetamide
CID 62686567
3,5-dimethoxy-N-[5-methyl-4-(3-methylphenyl)-1H-pyrazol-3-yl]benzamide
CID 53197830
2,5-difluoro-N-[5-methyl-4-(3-methylphenyl)-1H-pyrazol-3-yl]benzamide
CID 53197846
N-[5-methyl-4-(4-methylphenyl)-1H-pyrazol-3-yl]-3-phenylpropanamide
CID 53197929
2-(3-methylphenyl)-N-(1,4,6,7-tetrahydropyrano[4,3-c]pyrazol-3-yl)acetamide
CID 167925151
2-(2-chloro-4-methoxyphenyl)-N-(5-methyl-4-phenyl-1H-pyrazol-3-yl)acetamide
CID 53198503
N-(3,5-dimethylphenyl)-2-(3-methylphenyl)acetamide
CID 11839743
2-(3-methylphenyl)-N-phenylacetamide
CID 6470005
3-[5-methyl-4-(3-methylphenyl)-1H-pyrazol-3-yl]propanoic acid
CID 82478389
1-cyclobutyl-N-[5-methyl-4-(3-methylphenyl)-1H-pyrazol-3-yl]pyrazole-4-carboxamide
CID 138020489
2-(3-methylphenyl)-N-[4-(2H-tetrazol-5-yl)phenyl]acetamide
CID 110720231

Frequently Asked Questions

What is the IUPAC name of N-[5-methyl-4-(3-methylphenyl)-1H-pyrazol-3-yl]-2-(3-methylphenyl)acetamide?
The IUPAC name of N-[5-methyl-4-(3-methylphenyl)-1H-pyrazol-3-yl]-2-(3-methylphenyl)acetamide (CID 53197836) is N-[5-methyl-4-(3-methylphenyl)-1H-pyrazol-3-yl]-2-(3-methylphenyl)acetamide.
What is the SMILES notation for N-[5-methyl-4-(3-methylphenyl)-1H-pyrazol-3-yl]-2-(3-methylphenyl)acetamide?
The canonical SMILES for N-[5-methyl-4-(3-methylphenyl)-1H-pyrazol-3-yl]-2-(3-methylphenyl)acetamide is Cc1cccc(CC(=O)Nc2n[nH]c(C)c2-c2cccc(C)c2)c1.
What is the InChIKey of N-[5-methyl-4-(3-methylphenyl)-1H-pyrazol-3-yl]-2-(3-methylphenyl)acetamide?
The InChIKey is RSKONEBZUKDEHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N3O/c1-13-6-4-8-16(10-13)12-18(24)21-20-19(15(3)22-23-20)17-9-5-7-14(2)11-17/h4-11H,12H2,1-3H3,(H2,21,22,23,24).
What are the key properties of N-[5-methyl-4-(3-methylphenyl)-1H-pyrazol-3-yl]-2-(3-methylphenyl)acetamide?
N-[5-methyl-4-(3-methylphenyl)-1H-pyrazol-3-yl]-2-(3-methylphenyl)acetamide has a molecular weight of 319.41 g/mol, XLogP of 4.18, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-methyl-4-(3-methylphenyl)-1H-pyrazol-3-yl]-2-(3-methylphenyl)acetamide is sourced from PubChem (CID 53197836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).