2-[4-(1-methylimidazol-2-yl)pyrazol-1-yl]-N-(2-methylpyrazol-3-yl)acetamide

C13H15N7O — CID 46994581

IUPAC2-[4-(1-methylimidazol-2-yl)pyrazol-1-yl]-N-(2-methylpyrazol-3-yl)acetamide
SMILESCn1ccnc1-c1cnn(CC(=O)Nc2ccnn2C)c1
InChIInChI=1S/C13H15N7O/c1-18-6-5-14-13(18)10-7-16-20(8-10)9-12(21)17-11-3-4-15-19(11)2/h3-8H,9H2,1-2H3,(H,17,21)
InChIKeyOJMFSYNFZTYGMB-UHFFFAOYSA-N
MW285.31 g/mol
LogP0.66
Rot. Bonds4

About 2-[4-(1-methylimidazol-2-yl)pyrazol-1-yl]-N-(2-methylpyrazol-3-yl)acetamide

2-[4-(1-methylimidazol-2-yl)pyrazol-1-yl]-N-(2-methylpyrazol-3-yl)acetamide (PubChem CID 46994581) has the molecular formula C13H15N7O and a molecular weight of 285.31 g/mol. Its IUPAC name is 2-[4-(1-methylimidazol-2-yl)pyrazol-1-yl]-N-(2-methylpyrazol-3-yl)acetamide.

Molecular Properties

Compound Name2-[4-(1-methylimidazol-2-yl)pyrazol-1-yl]-N-(2-methylpyrazol-3-yl)acetamide
PubChem CID46994581
Molecular FormulaC13H15N7O
Molecular Weight285.31 g/mol
Exact Mass285.13
IUPAC Name2-[4-(1-methylimidazol-2-yl)pyrazol-1-yl]-N-(2-methylpyrazol-3-yl)acetamide
SMILESCn1ccnc1-c1cnn(CC(=O)Nc2ccnn2C)c1
InChIInChI=1S/C13H15N7O/c1-18-6-5-14-13(18)10-7-16-20(8-10)9-12(21)17-11-3-4-15-19(11)2/h3-8H,9H2,1-2H3,(H,17,21)
InChIKeyOJMFSYNFZTYGMB-UHFFFAOYSA-N
XLogP0.66
TPSA82.56 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.31
LogP ≤ 50.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

4-{4-[3-(1h-Imidazol-1-Yl)propyl]-5-Methyl-4h-1,2,4-Triazol-3-Yl}-1-Methyl-1h-Pyrazol-5-Amine
CID 1472726
N-[2-(3-methylbutan-2-yl)pyrazol-3-yl]-2-(2-propan-2-ylimidazol-1-yl)acetamide
CID 46983158
2-[2-[(3,5-dimethyl-1,2,4-triazol-1-yl)methyl]pyrrolidin-1-yl]-N-(2-propylpyrazol-3-yl)acetamide
CID 53572990
2-[2-[(3,5-dimethyl-1,2,4-triazol-1-yl)methyl]pyrrolidin-1-yl]-N-(2-propan-2-ylpyrazol-3-yl)acetamide
CID 53573041
N-[2-[[1-(3-imidazol-1-ylpropyl)pyrazol-3-yl]amino]-2-oxoethyl]-3,3-dimethylbutanamide
CID 72133023
N-[2-methyl-5-(1-methylpyrazol-4-yl)-[1,2,4]triazolo[1,5-c]pyrimidin-7-yl]acetamide
CID 166746677
N-(2-ethyl-2H-1,2,3-triazol-4-yl)-2-{4-[5-fluoro-4-(methylamino)pyrimidin-2-yl]-1H-pyrazol-1-yl}acetamide
CID 31125751
2-(3-cyano-1,2,4-triazol-1-yl)-N-[2-(2-methylpropyl)pyrazol-3-yl]acetamide
CID 45834453
2-(2-methyl-1H-imidazol-1-yl)-N-(1-methyl-1H-pyrazol-5-yl)acetamide
CID 46988914
N-(1-tert-butylpyrazol-3-yl)-4-(2-methylimidazol-1-yl)butanamide
CID 56783099
1-[[1-(Difluoromethyl)imidazol-2-yl]methyl]-3-[1-[2-(dimethylamino)ethyl]pyrazol-3-yl]-1-methylurea
CID 71991896
N-(2,5-dimethylpyrazol-3-yl)-2-(2-ethylimidazol-1-yl)acetamide
CID 75433248

Frequently Asked Questions

What is the IUPAC name of 2-[4-(1-methylimidazol-2-yl)pyrazol-1-yl]-N-(2-methylpyrazol-3-yl)acetamide?
The IUPAC name of 2-[4-(1-methylimidazol-2-yl)pyrazol-1-yl]-N-(2-methylpyrazol-3-yl)acetamide (CID 46994581) is 2-[4-(1-methylimidazol-2-yl)pyrazol-1-yl]-N-(2-methylpyrazol-3-yl)acetamide.
What is the SMILES notation for 2-[4-(1-methylimidazol-2-yl)pyrazol-1-yl]-N-(2-methylpyrazol-3-yl)acetamide?
The canonical SMILES for 2-[4-(1-methylimidazol-2-yl)pyrazol-1-yl]-N-(2-methylpyrazol-3-yl)acetamide is Cn1ccnc1-c1cnn(CC(=O)Nc2ccnn2C)c1.
What is the InChIKey of 2-[4-(1-methylimidazol-2-yl)pyrazol-1-yl]-N-(2-methylpyrazol-3-yl)acetamide?
The InChIKey is OJMFSYNFZTYGMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N7O/c1-18-6-5-14-13(18)10-7-16-20(8-10)9-12(21)17-11-3-4-15-19(11)2/h3-8H,9H2,1-2H3,(H,17,21).
What are the key properties of 2-[4-(1-methylimidazol-2-yl)pyrazol-1-yl]-N-(2-methylpyrazol-3-yl)acetamide?
2-[4-(1-methylimidazol-2-yl)pyrazol-1-yl]-N-(2-methylpyrazol-3-yl)acetamide has a molecular weight of 285.31 g/mol, XLogP of 0.66, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(1-methylimidazol-2-yl)pyrazol-1-yl]-N-(2-methylpyrazol-3-yl)acetamide is sourced from PubChem (CID 46994581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).