N-(4,5-dimethyl-1H-pyrazol-3-yl)acetamide;ethane

C9H17N3O — CID 144617181

IUPACN-(4,5-dimethyl-1H-pyrazol-3-yl)acetamide;ethane
SMILESCC.CC(=O)Nc1n[nH]c(C)c1C
InChIInChI=1S/C7H11N3O.C2H6/c1-4-5(2)9-10-7(4)8-6(3)11;1-2/h1-3H3,(H2,8,9,10,11);1-2H3
InChIKeyCZKZITMNIBMYIP-UHFFFAOYSA-N
MW183.25 g/mol
LogP2.01
Rot. Bonds1

About N-(4,5-dimethyl-1H-pyrazol-3-yl)acetamide;ethane

N-(4,5-dimethyl-1H-pyrazol-3-yl)acetamide;ethane (PubChem CID 144617181) has the molecular formula C9H17N3O and a molecular weight of 183.25 g/mol. Its IUPAC name is N-(4,5-dimethyl-1H-pyrazol-3-yl)acetamide;ethane.

Molecular Properties

Compound NameN-(4,5-dimethyl-1H-pyrazol-3-yl)acetamide;ethane
PubChem CID144617181
Molecular FormulaC9H17N3O
Molecular Weight183.25 g/mol
Exact Mass183.14
IUPAC NameN-(4,5-dimethyl-1H-pyrazol-3-yl)acetamide;ethane
SMILESCC.CC(=O)Nc1n[nH]c(C)c1C
InChIInChI=1S/C7H11N3O.C2H6/c1-4-5(2)9-10-7(4)8-6(3)11;1-2/h1-3H3,(H2,8,9,10,11);1-2H3
InChIKeyCZKZITMNIBMYIP-UHFFFAOYSA-N
XLogP2.01
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.25
LogP ≤ 52.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-(4,5-dimethyl-1H-pyrazol-3-yl)acetamide;ethane 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-(4,5-dimethyl-1H-pyrazol-3-yl)acetamide;ethane?
The IUPAC name of N-(4,5-dimethyl-1H-pyrazol-3-yl)acetamide;ethane (CID 144617181) is N-(4,5-dimethyl-1H-pyrazol-3-yl)acetamide;ethane.
What is the SMILES notation for N-(4,5-dimethyl-1H-pyrazol-3-yl)acetamide;ethane?
The canonical SMILES for N-(4,5-dimethyl-1H-pyrazol-3-yl)acetamide;ethane is CC.CC(=O)Nc1n[nH]c(C)c1C.
What is the InChIKey of N-(4,5-dimethyl-1H-pyrazol-3-yl)acetamide;ethane?
The InChIKey is CZKZITMNIBMYIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3O.C2H6/c1-4-5(2)9-10-7(4)8-6(3)11;1-2/h1-3H3,(H2,8,9,10,11);1-2H3.
What are the key properties of N-(4,5-dimethyl-1H-pyrazol-3-yl)acetamide;ethane?
N-(4,5-dimethyl-1H-pyrazol-3-yl)acetamide;ethane has a molecular weight of 183.25 g/mol, XLogP of 2.01, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4,5-dimethyl-1H-pyrazol-3-yl)acetamide;ethane is sourced from PubChem (CID 144617181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).