N-[4-(4-methoxyphenyl)-1,3-dimethylpyrazol-5-yl]-2-(2-methylimidazol-1-yl)acetamide

C18H21N5O2 — CID 134704405

IUPACN-[4-(4-methoxyphenyl)-1,3-dimethylpyrazol-5-yl]-2-(2-methylimidazol-1-yl)acetamide
SMILESCOc1ccc(-c2c(C)nn(C)c2NC(=O)Cn2ccnc2C)cc1
InChIInChI=1S/C18H21N5O2/c1-12-17(14-5-7-15(25-4)8-6-14)18(22(3)21-12)20-16(24)11-23-10-9-19-13(23)2/h5-10H,11H2,1-4H3,(H,20,24)
InChIKeyWNXSTGDTFKHYAI-UHFFFAOYSA-N
MW339.40 g/mol
LogP2.55
Rot. Bonds5

About N-[4-(4-methoxyphenyl)-1,3-dimethylpyrazol-5-yl]-2-(2-methylimidazol-1-yl)acetamide

N-[4-(4-methoxyphenyl)-1,3-dimethylpyrazol-5-yl]-2-(2-methylimidazol-1-yl)acetamide (PubChem CID 134704405) has the molecular formula C18H21N5O2 and a molecular weight of 339.40 g/mol. Its IUPAC name is N-[4-(4-methoxyphenyl)-1,3-dimethylpyrazol-5-yl]-2-(2-methylimidazol-1-yl)acetamide.

Molecular Properties

Compound NameN-[4-(4-methoxyphenyl)-1,3-dimethylpyrazol-5-yl]-2-(2-methylimidazol-1-yl)acetamide
PubChem CID134704405
Molecular FormulaC18H21N5O2
Molecular Weight339.40 g/mol
Exact Mass339.17
IUPAC NameN-[4-(4-methoxyphenyl)-1,3-dimethylpyrazol-5-yl]-2-(2-methylimidazol-1-yl)acetamide
SMILESCOc1ccc(-c2c(C)nn(C)c2NC(=O)Cn2ccnc2C)cc1
InChIInChI=1S/C18H21N5O2/c1-12-17(14-5-7-15(25-4)8-6-14)18(22(3)21-12)20-16(24)11-23-10-9-19-13(23)2/h5-10H,11H2,1-4H3,(H,20,24)
InChIKeyWNXSTGDTFKHYAI-UHFFFAOYSA-N
XLogP2.55
TPSA73.97 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.40
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(4-methoxyphenyl)-2-(2-methylimidazol-1-yl)acetamide
CID 55028374
N-[4-(4-methoxyphenyl)-1,3-dimethylpyrazol-5-yl]-2-phenoxyacetamide
CID 134710429
N-[4-(4-methoxyphenyl)-1,3-dimethylpyrazol-5-yl]thiomorpholine-4-carboxamide
CID 72889378
2-[2-[[4-(4-methoxyphenyl)-1-methyl-3-(trifluoromethyl)pyrazol-5-yl]amino]-2-oxoethyl]sulfanylacetic acid
CID 2809956
N-[4-(4-bromophenyl)-1,3-dimethylpyrazol-5-yl]-2-(4-ethylphenoxy)acetamide
CID 56536068
4-(2-methylimidazol-1-yl)-N-(2,4,5-trimethylpyrazol-3-yl)butanamide
CID 56782546
N-[4-(4-bromophenyl)-1,3-dimethylpyrazol-5-yl]-3-(4-fluorophenoxy)propanamide
CID 56573561
3-[4-(4-methoxyphenyl)-1,3-dimethylpyrazol-5-yl]-1-methyl-1-[(1S)-1-(1,2-oxazol-3-yl)ethyl]urea
CID 97279827
4-[(1,3-dimethyl-4-phenylpyrazol-5-yl)amino]-4-oxobutanoic acid
CID 134712423
N-[3-(4-fluorophenyl)-1-methyl-4-pyridin-4-ylpyrazol-5-yl]-2-(4-methoxyphenyl)acetamide
CID 18674002
N-[4-(4-bromophenyl)-1,3-dimethylpyrazol-5-yl]-2-(4-methylphenyl)sulfanylacetamide
CID 56536076
1-[2-(4-methoxyphenoxy)ethyl]-2-methylimidazole
CID 887351

Frequently Asked Questions

What is the IUPAC name of N-[4-(4-methoxyphenyl)-1,3-dimethylpyrazol-5-yl]-2-(2-methylimidazol-1-yl)acetamide?
The IUPAC name of N-[4-(4-methoxyphenyl)-1,3-dimethylpyrazol-5-yl]-2-(2-methylimidazol-1-yl)acetamide (CID 134704405) is N-[4-(4-methoxyphenyl)-1,3-dimethylpyrazol-5-yl]-2-(2-methylimidazol-1-yl)acetamide.
What is the SMILES notation for N-[4-(4-methoxyphenyl)-1,3-dimethylpyrazol-5-yl]-2-(2-methylimidazol-1-yl)acetamide?
The canonical SMILES for N-[4-(4-methoxyphenyl)-1,3-dimethylpyrazol-5-yl]-2-(2-methylimidazol-1-yl)acetamide is COc1ccc(-c2c(C)nn(C)c2NC(=O)Cn2ccnc2C)cc1.
What is the InChIKey of N-[4-(4-methoxyphenyl)-1,3-dimethylpyrazol-5-yl]-2-(2-methylimidazol-1-yl)acetamide?
The InChIKey is WNXSTGDTFKHYAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N5O2/c1-12-17(14-5-7-15(25-4)8-6-14)18(22(3)21-12)20-16(24)11-23-10-9-19-13(23)2/h5-10H,11H2,1-4H3,(H,20,24).
What are the key properties of N-[4-(4-methoxyphenyl)-1,3-dimethylpyrazol-5-yl]-2-(2-methylimidazol-1-yl)acetamide?
N-[4-(4-methoxyphenyl)-1,3-dimethylpyrazol-5-yl]-2-(2-methylimidazol-1-yl)acetamide has a molecular weight of 339.40 g/mol, XLogP of 2.55, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(4-methoxyphenyl)-1,3-dimethylpyrazol-5-yl]-2-(2-methylimidazol-1-yl)acetamide is sourced from PubChem (CID 134704405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).