N-methyl-2-[4-(2-methyl-4-pyridinyl)pyrazol-1-yl]acetamide

C12H14N4O — CID 121497314

IUPACN-methyl-2-[4-(2-methyl-4-pyridinyl)pyrazol-1-yl]acetamide
SMILESCNC(=O)Cn1cc(-c2ccnc(C)c2)cn1
InChIInChI=1S/C12H14N4O/c1-9-5-10(3-4-14-9)11-6-15-16(7-11)8-12(17)13-2/h3-7H,8H2,1-2H3,(H,13,17)
InChIKeyIIAIZLJJTHRWMZ-UHFFFAOYSA-N
MW230.27 g/mol
LogP1.00
Rot. Bonds3

About N-methyl-2-[4-(2-methyl-4-pyridinyl)pyrazol-1-yl]acetamide

N-methyl-2-[4-(2-methyl-4-pyridinyl)pyrazol-1-yl]acetamide (PubChem CID 121497314) has the molecular formula C12H14N4O and a molecular weight of 230.27 g/mol. Its IUPAC name is N-methyl-2-[4-(2-methyl-4-pyridinyl)pyrazol-1-yl]acetamide.

Molecular Properties

Compound NameN-methyl-2-[4-(2-methyl-4-pyridinyl)pyrazol-1-yl]acetamide
PubChem CID121497314
Molecular FormulaC12H14N4O
Molecular Weight230.27 g/mol
Exact Mass230.12
IUPAC NameN-methyl-2-[4-(2-methyl-4-pyridinyl)pyrazol-1-yl]acetamide
SMILESCNC(=O)Cn1cc(-c2ccnc(C)c2)cn1
InChIInChI=1S/C12H14N4O/c1-9-5-10(3-4-14-9)11-6-15-16(7-11)8-12(17)13-2/h3-7H,8H2,1-2H3,(H,13,17)
InChIKeyIIAIZLJJTHRWMZ-UHFFFAOYSA-N
XLogP1.00
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.27
LogP ≤ 51.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-methyl-2-[4-(2-methyl-4-pyridinyl)pyrazol-1-yl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[4-(2-methyl-4-pyridinyl)pyrazol-1-yl]acetamide?
The IUPAC name of N-methyl-2-[4-(2-methyl-4-pyridinyl)pyrazol-1-yl]acetamide (CID 121497314) is N-methyl-2-[4-(2-methyl-4-pyridinyl)pyrazol-1-yl]acetamide.
What is the SMILES notation for N-methyl-2-[4-(2-methyl-4-pyridinyl)pyrazol-1-yl]acetamide?
The canonical SMILES for N-methyl-2-[4-(2-methyl-4-pyridinyl)pyrazol-1-yl]acetamide is CNC(=O)Cn1cc(-c2ccnc(C)c2)cn1.
What is the InChIKey of N-methyl-2-[4-(2-methyl-4-pyridinyl)pyrazol-1-yl]acetamide?
The InChIKey is IIAIZLJJTHRWMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4O/c1-9-5-10(3-4-14-9)11-6-15-16(7-11)8-12(17)13-2/h3-7H,8H2,1-2H3,(H,13,17).
What are the key properties of N-methyl-2-[4-(2-methyl-4-pyridinyl)pyrazol-1-yl]acetamide?
N-methyl-2-[4-(2-methyl-4-pyridinyl)pyrazol-1-yl]acetamide has a molecular weight of 230.27 g/mol, XLogP of 1.00, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[4-(2-methyl-4-pyridinyl)pyrazol-1-yl]acetamide is sourced from PubChem (CID 121497314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).