N-(4,5-dimethyl-1H-pyrazol-3-yl)-2-pyridin-2-ylacetamide

C12H14N4O — CID 104620045

IUPACN-(4,5-dimethyl-1H-pyrazol-3-yl)-2-pyridin-2-ylacetamide
SMILESCc1[nH]nc(NC(=O)Cc2ccccn2)c1C
InChIInChI=1S/C12H14N4O/c1-8-9(2)15-16-12(8)14-11(17)7-10-5-3-4-6-13-10/h3-6H,7H2,1-2H3,(H2,14,15,16,17)
InChIKeyWWMCRSGPXKNBHY-UHFFFAOYSA-N
MW230.27 g/mol
LogP1.60
Rot. Bonds3

About N-(4,5-dimethyl-1H-pyrazol-3-yl)-2-pyridin-2-ylacetamide

N-(4,5-dimethyl-1H-pyrazol-3-yl)-2-pyridin-2-ylacetamide (PubChem CID 104620045) has the molecular formula C12H14N4O and a molecular weight of 230.27 g/mol. Its IUPAC name is N-(4,5-dimethyl-1H-pyrazol-3-yl)-2-pyridin-2-ylacetamide.

Molecular Properties

Compound NameN-(4,5-dimethyl-1H-pyrazol-3-yl)-2-pyridin-2-ylacetamide
PubChem CID104620045
Molecular FormulaC12H14N4O
Molecular Weight230.27 g/mol
Exact Mass230.12
IUPAC NameN-(4,5-dimethyl-1H-pyrazol-3-yl)-2-pyridin-2-ylacetamide
SMILESCc1[nH]nc(NC(=O)Cc2ccccn2)c1C
InChIInChI=1S/C12H14N4O/c1-8-9(2)15-16-12(8)14-11(17)7-10-5-3-4-6-13-10/h3-6H,7H2,1-2H3,(H2,14,15,16,17)
InChIKeyWWMCRSGPXKNBHY-UHFFFAOYSA-N
XLogP1.60
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.27
LogP ≤ 51.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-(aminomethyl)phenyl]-N-(4,5-dimethyl-1H-pyrazol-3-yl)acetamide
CID 104618675
N-(4,5-dimethyl-1H-pyrazol-3-yl)-2-naphthalen-1-ylacetamide
CID 115594855
N-(4,5-dimethyl-1H-pyrazol-3-yl)-2-(2-methoxyphenyl)acetamide
CID 112687368
N-(2,3-dimethylphenyl)-2-pyridin-2-ylacetamide
CID 110696972
N-(4,5-dimethyl-1H-pyrazol-3-yl)-2-(2-methoxyphenoxy)acetamide
CID 115594830
N-phenyl-2-pyridin-2-ylacetamide chloride
CID 21234777
N-(3-methoxy-1H-1,2,4-triazol-5-yl)-2-pyridin-2-ylacetamide
CID 83101826
2-amino-N-(4,5-dimethyl-1H-pyrazol-3-yl)acetamide
CID 104618733
2-chloro-N-(4,5-dimethyl-1H-pyrazol-3-yl)acetamide
CID 104617747
N-(4,5-dimethyl-1H-pyrazol-3-yl)-2-(9-methylcarbazol-3-yl)acetamide
CID 29209063
N-(2-hydroxyphenyl)-2-pyridin-2-ylacetamide
CID 11746373
N-[2-[(4,5-dimethyl-1H-pyrazol-3-yl)amino]-2-oxoethyl]-N-methylbenzamide
CID 115610254

Frequently Asked Questions

What is the IUPAC name of N-(4,5-dimethyl-1H-pyrazol-3-yl)-2-pyridin-2-ylacetamide?
The IUPAC name of N-(4,5-dimethyl-1H-pyrazol-3-yl)-2-pyridin-2-ylacetamide (CID 104620045) is N-(4,5-dimethyl-1H-pyrazol-3-yl)-2-pyridin-2-ylacetamide.
What is the SMILES notation for N-(4,5-dimethyl-1H-pyrazol-3-yl)-2-pyridin-2-ylacetamide?
The canonical SMILES for N-(4,5-dimethyl-1H-pyrazol-3-yl)-2-pyridin-2-ylacetamide is Cc1[nH]nc(NC(=O)Cc2ccccn2)c1C.
What is the InChIKey of N-(4,5-dimethyl-1H-pyrazol-3-yl)-2-pyridin-2-ylacetamide?
The InChIKey is WWMCRSGPXKNBHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4O/c1-8-9(2)15-16-12(8)14-11(17)7-10-5-3-4-6-13-10/h3-6H,7H2,1-2H3,(H2,14,15,16,17).
What are the key properties of N-(4,5-dimethyl-1H-pyrazol-3-yl)-2-pyridin-2-ylacetamide?
N-(4,5-dimethyl-1H-pyrazol-3-yl)-2-pyridin-2-ylacetamide has a molecular weight of 230.27 g/mol, XLogP of 1.60, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4,5-dimethyl-1H-pyrazol-3-yl)-2-pyridin-2-ylacetamide is sourced from PubChem (CID 104620045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).