N-(2,5-dimethylpyrazol-3-yl)-5-propan-2-yl-1H-pyrazole-3-carboxamide

C12H17N5O — CID 47283794

IUPACN-(2,5-dimethylpyrazol-3-yl)-5-propan-2-yl-1H-pyrazole-3-carboxamide
SMILESCc1cc(NC(=O)c2cc(C(C)C)[nH]n2)n(C)n1
InChIInChI=1S/C12H17N5O/c1-7(2)9-6-10(15-14-9)12(18)13-11-5-8(3)16-17(11)4/h5-7H,1-4H3,(H,13,18)(H,14,15)
InChIKeyWCFUNMRTGNJRGU-UHFFFAOYSA-N
MW247.30 g/mol
LogP1.83
Rot. Bonds3

About N-(2,5-dimethylpyrazol-3-yl)-5-propan-2-yl-1H-pyrazole-3-carboxamide

N-(2,5-dimethylpyrazol-3-yl)-5-propan-2-yl-1H-pyrazole-3-carboxamide (PubChem CID 47283794) has the molecular formula C12H17N5O and a molecular weight of 247.30 g/mol. Its IUPAC name is N-(2,5-dimethylpyrazol-3-yl)-5-propan-2-yl-1H-pyrazole-3-carboxamide.

Molecular Properties

Compound NameN-(2,5-dimethylpyrazol-3-yl)-5-propan-2-yl-1H-pyrazole-3-carboxamide
PubChem CID47283794
Molecular FormulaC12H17N5O
Molecular Weight247.30 g/mol
Exact Mass247.14
IUPAC NameN-(2,5-dimethylpyrazol-3-yl)-5-propan-2-yl-1H-pyrazole-3-carboxamide
SMILESCc1cc(NC(=O)c2cc(C(C)C)[nH]n2)n(C)n1
InChIInChI=1S/C12H17N5O/c1-7(2)9-6-10(15-14-9)12(18)13-11-5-8(3)16-17(11)4/h5-7H,1-4H3,(H,13,18)(H,14,15)
InChIKeyWCFUNMRTGNJRGU-UHFFFAOYSA-N
XLogP1.83
TPSA75.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.30
LogP ≤ 51.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(2,5-dimethylpyrazol-3-yl)-5-propan-2-yl-1H-pyrazole-3-carboxamide 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-(2,5-dimethylpyrazol-3-yl)-5-propan-2-yl-1H-pyrazole-3-carboxamide?
The IUPAC name of N-(2,5-dimethylpyrazol-3-yl)-5-propan-2-yl-1H-pyrazole-3-carboxamide (CID 47283794) is N-(2,5-dimethylpyrazol-3-yl)-5-propan-2-yl-1H-pyrazole-3-carboxamide.
What is the SMILES notation for N-(2,5-dimethylpyrazol-3-yl)-5-propan-2-yl-1H-pyrazole-3-carboxamide?
The canonical SMILES for N-(2,5-dimethylpyrazol-3-yl)-5-propan-2-yl-1H-pyrazole-3-carboxamide is Cc1cc(NC(=O)c2cc(C(C)C)[nH]n2)n(C)n1.
What is the InChIKey of N-(2,5-dimethylpyrazol-3-yl)-5-propan-2-yl-1H-pyrazole-3-carboxamide?
The InChIKey is WCFUNMRTGNJRGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N5O/c1-7(2)9-6-10(15-14-9)12(18)13-11-5-8(3)16-17(11)4/h5-7H,1-4H3,(H,13,18)(H,14,15).
What are the key properties of N-(2,5-dimethylpyrazol-3-yl)-5-propan-2-yl-1H-pyrazole-3-carboxamide?
N-(2,5-dimethylpyrazol-3-yl)-5-propan-2-yl-1H-pyrazole-3-carboxamide has a molecular weight of 247.30 g/mol, XLogP of 1.83, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dimethylpyrazol-3-yl)-5-propan-2-yl-1H-pyrazole-3-carboxamide is sourced from PubChem (CID 47283794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).