2-(2,6-dimethoxyphenyl)-N-(4-methyl-1-phenylpyrazol-5-yl)acetamide

C20H21N3O3 — CID 75468723

IUPAC2-(2,6-dimethoxyphenyl)-N-(4-methyl-1-phenylpyrazol-5-yl)acetamide
SMILESCOc1cccc(OC)c1CC(=O)Nc1c(C)cnn1-c1ccccc1
InChIInChI=1S/C20H21N3O3/c1-14-13-21-23(15-8-5-4-6-9-15)20(14)22-19(24)12-16-17(25-2)10-7-11-18(16)26-3/h4-11,13H,12H2,1-3H3,(H,22,24)
InChIKeyFWCQQKRTKGWGCD-UHFFFAOYSA-N
MW351.41 g/mol
LogP3.38
Rot. Bonds6

About 2-(2,6-dimethoxyphenyl)-N-(4-methyl-1-phenylpyrazol-5-yl)acetamide

2-(2,6-dimethoxyphenyl)-N-(4-methyl-1-phenylpyrazol-5-yl)acetamide (PubChem CID 75468723) has the molecular formula C20H21N3O3 and a molecular weight of 351.41 g/mol. Its IUPAC name is 2-(2,6-dimethoxyphenyl)-N-(4-methyl-1-phenylpyrazol-5-yl)acetamide.

Molecular Properties

Compound Name2-(2,6-dimethoxyphenyl)-N-(4-methyl-1-phenylpyrazol-5-yl)acetamide
PubChem CID75468723
Molecular FormulaC20H21N3O3
Molecular Weight351.41 g/mol
Exact Mass351.16
IUPAC Name2-(2,6-dimethoxyphenyl)-N-(4-methyl-1-phenylpyrazol-5-yl)acetamide
SMILESCOc1cccc(OC)c1CC(=O)Nc1c(C)cnn1-c1ccccc1
InChIInChI=1S/C20H21N3O3/c1-14-13-21-23(15-8-5-4-6-9-15)20(14)22-19(24)12-16-17(25-2)10-7-11-18(16)26-3/h4-11,13H,12H2,1-3H3,(H,22,24)
InChIKeyFWCQQKRTKGWGCD-UHFFFAOYSA-N
XLogP3.38
TPSA65.38 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.41
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3,4,5-trimethoxy-N-(4-methyl-1-phenylpyrazol-5-yl)benzamide
CID 75468504
4-methoxy-N-(4-methyl-1-phenylpyrazol-5-yl)-1-phenylpyrazole-3-carboxamide
CID 167751714
N-(4-methyl-1-phenylpyrazol-5-yl)-3-(2-oxo-1-pyridinyl)propanamide
CID 100642790
3-(difluoromethoxy)-4-methoxy-N-(4-methyl-1-phenylpyrazol-5-yl)benzamide
CID 75468505
5-methoxy-N-(4-methyl-1-phenylpyrazol-5-yl)-2,3-dihydro-1,4-benzodioxine-7-carboxamide
CID 75468501
N-(4-methyl-1-phenylpyrazol-5-yl)pyridine-3-carboxamide
CID 99818669
ethyl 5-[[2-(4-chlorophenyl)acetyl]amino]-1-phenylpyrazole-4-carboxylate
CID 5086610
2-(2-chloro-6-methoxyphenyl)-N-(2,4,5-trimethylpyrazol-3-yl)acetamide
CID 75507798
3-[[2-(2,6-dimethoxyphenyl)acetyl]amino]butanoic acid
CID 119347863
ethyl 5-(butanoylamino)-1-phenylpyrazole-4-carboxylate
CID 5054602
3-fluoro-N-(4-methyl-1-phenylpyrazol-5-yl)pyridine-4-carboxamide
CID 71859005
N-(4-methyl-1-phenylpyrazol-5-yl)methanesulfonamide
CID 91649217

Frequently Asked Questions

What is the IUPAC name of 2-(2,6-dimethoxyphenyl)-N-(4-methyl-1-phenylpyrazol-5-yl)acetamide?
The IUPAC name of 2-(2,6-dimethoxyphenyl)-N-(4-methyl-1-phenylpyrazol-5-yl)acetamide (CID 75468723) is 2-(2,6-dimethoxyphenyl)-N-(4-methyl-1-phenylpyrazol-5-yl)acetamide.
What is the SMILES notation for 2-(2,6-dimethoxyphenyl)-N-(4-methyl-1-phenylpyrazol-5-yl)acetamide?
The canonical SMILES for 2-(2,6-dimethoxyphenyl)-N-(4-methyl-1-phenylpyrazol-5-yl)acetamide is COc1cccc(OC)c1CC(=O)Nc1c(C)cnn1-c1ccccc1.
What is the InChIKey of 2-(2,6-dimethoxyphenyl)-N-(4-methyl-1-phenylpyrazol-5-yl)acetamide?
The InChIKey is FWCQQKRTKGWGCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N3O3/c1-14-13-21-23(15-8-5-4-6-9-15)20(14)22-19(24)12-16-17(25-2)10-7-11-18(16)26-3/h4-11,13H,12H2,1-3H3,(H,22,24).
What are the key properties of 2-(2,6-dimethoxyphenyl)-N-(4-methyl-1-phenylpyrazol-5-yl)acetamide?
2-(2,6-dimethoxyphenyl)-N-(4-methyl-1-phenylpyrazol-5-yl)acetamide has a molecular weight of 351.41 g/mol, XLogP of 3.38, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-dimethoxyphenyl)-N-(4-methyl-1-phenylpyrazol-5-yl)acetamide is sourced from PubChem (CID 75468723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).