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

C19H19N3O — CID 9319157

IUPAC2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-(4-phenylphenyl)acetamide
SMILESCc1n[nH]c(C)c1CC(=O)Nc1ccc(-c2ccccc2)cc1
InChIInChI=1S/C19H19N3O/c1-13-18(14(2)22-21-13)12-19(23)20-17-10-8-16(9-11-17)15-6-4-3-5-7-15/h3-11H,12H2,1-2H3,(H,20,23)(H,21,22)
InChIKeyFDSIQBFSNYGEAV-UHFFFAOYSA-N
MW305.38 g/mol
LogP3.87
Rot. Bonds4

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

2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-(4-phenylphenyl)acetamide (PubChem CID 9319157) has the molecular formula C19H19N3O and a molecular weight of 305.38 g/mol. Its IUPAC name is 2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-(4-phenylphenyl)acetamide.

Molecular Properties

Compound Name2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-(4-phenylphenyl)acetamide
PubChem CID9319157
Molecular FormulaC19H19N3O
Molecular Weight305.38 g/mol
Exact Mass305.15
IUPAC Name2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-(4-phenylphenyl)acetamide
SMILESCc1n[nH]c(C)c1CC(=O)Nc1ccc(-c2ccccc2)cc1
InChIInChI=1S/C19H19N3O/c1-13-18(14(2)22-21-13)12-19(23)20-17-10-8-16(9-11-17)15-6-4-3-5-7-15/h3-11H,12H2,1-2H3,(H,20,23)(H,21,22)
InChIKeyFDSIQBFSNYGEAV-UHFFFAOYSA-N
XLogP3.87
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.38
LogP ≤ 53.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[4-(2-hydroxyethyl)phenyl]acetamide
CID 61221604
5-[[2-(3,5-dimethyl-1H-pyrazol-4-yl)acetyl]amino]-2-methylbenzoic acid
CID 63654718
2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[4-(5-propan-2-yl-1,3-oxazol-2-yl)phenyl]acetamide
CID 100671914
2-bromo-5-[[2-(3,5-dimethyl-1H-pyrazol-4-yl)acetyl]amino]benzoic acid
CID 115295595
N-(4-methoxyphenyl)-2-[3-(4-methoxyphenyl)-5-methyl-1H-pyrazol-4-yl]acetamide
CID 51048605
2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-(5-methyl-1H-pyrazol-3-yl)acetamide
CID 55259828
2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-(2H-triazol-4-yl)acetamide
CID 138027211
2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[(2S)-2-phenylbutan-2-yl]acetamide
CID 100671479
N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-2-phenylacetamide
CID 110442349
2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[5-(4-propylphenyl)-1H-pyrazol-3-yl]acetamide
CID 126796562
2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-(2-propan-2-ylindazol-5-yl)acetamide
CID 100671901
2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[(2R,3S)-3-hydroxy-4-phenylbutan-2-yl]acetamide
CID 99825884

Frequently Asked Questions

What is the IUPAC name of 2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-(4-phenylphenyl)acetamide?
The IUPAC name of 2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-(4-phenylphenyl)acetamide (CID 9319157) is 2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-(4-phenylphenyl)acetamide.
What is the SMILES notation for 2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-(4-phenylphenyl)acetamide?
The canonical SMILES for 2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-(4-phenylphenyl)acetamide is Cc1n[nH]c(C)c1CC(=O)Nc1ccc(-c2ccccc2)cc1.
What is the InChIKey of 2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-(4-phenylphenyl)acetamide?
The InChIKey is FDSIQBFSNYGEAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O/c1-13-18(14(2)22-21-13)12-19(23)20-17-10-8-16(9-11-17)15-6-4-3-5-7-15/h3-11H,12H2,1-2H3,(H,20,23)(H,21,22).
What are the key properties of 2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-(4-phenylphenyl)acetamide?
2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-(4-phenylphenyl)acetamide has a molecular weight of 305.38 g/mol, XLogP of 3.87, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-(4-phenylphenyl)acetamide is sourced from PubChem (CID 9319157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).