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

C9H15N3O — CID 910778

IUPACN-(3,5-dimethyl-1H-pyrazol-4-yl)-2-methylpropanamide
SMILESCc1n[nH]c(C)c1NC(=O)C(C)C
InChIInChI=1S/C9H15N3O/c1-5(2)9(13)10-8-6(3)11-12-7(8)4/h5H,1-4H3,(H,10,13)(H,11,12)
InChIKeyJNMAXAINSRIRHP-UHFFFAOYSA-N
MW181.24 g/mol
LogP1.62
Rot. Bonds2

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

N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-methylpropanamide (PubChem CID 910778) has the molecular formula C9H15N3O and a molecular weight of 181.24 g/mol. Its IUPAC name is N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-methylpropanamide.

Molecular Properties

Compound NameN-(3,5-dimethyl-1H-pyrazol-4-yl)-2-methylpropanamide
PubChem CID910778
Molecular FormulaC9H15N3O
Molecular Weight181.24 g/mol
Exact Mass181.12
IUPAC NameN-(3,5-dimethyl-1H-pyrazol-4-yl)-2-methylpropanamide
SMILESCc1n[nH]c(C)c1NC(=O)C(C)C
InChIInChI=1S/C9H15N3O/c1-5(2)9(13)10-8-6(3)11-12-7(8)4/h5H,1-4H3,(H,10,13)(H,11,12)
InChIKeyJNMAXAINSRIRHP-UHFFFAOYSA-N
XLogP1.62
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.24
LogP ≤ 51.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-methylpropanamide 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-(3,5-dimethyl-1H-pyrazol-4-yl)-2-methylpropanamide?
The IUPAC name of N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-methylpropanamide (CID 910778) is N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-methylpropanamide.
What is the SMILES notation for N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-methylpropanamide?
The canonical SMILES for N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-methylpropanamide is Cc1n[nH]c(C)c1NC(=O)C(C)C.
What is the InChIKey of N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-methylpropanamide?
The InChIKey is JNMAXAINSRIRHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O/c1-5(2)9(13)10-8-6(3)11-12-7(8)4/h5H,1-4H3,(H,10,13)(H,11,12).
What are the key properties of N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-methylpropanamide?
N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-methylpropanamide has a molecular weight of 181.24 g/mol, XLogP of 1.62, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-methylpropanamide is sourced from PubChem (CID 910778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).