N-(1,5-dimethylpyrazol-3-yl)-2-fluoro-2-methylpropanamide

C9H14FN3O — CID 130165229

IUPACN-(1,5-dimethylpyrazol-3-yl)-2-fluoro-2-methylpropanamide
SMILESCc1cc(NC(=O)C(C)(C)F)nn1C
InChIInChI=1S/C9H14FN3O/c1-6-5-7(12-13(6)4)11-8(14)9(2,3)10/h5H,1-4H3,(H,11,12,14)
InChIKeyFEEKHVOCYPDLIV-UHFFFAOYSA-N
MW199.23 g/mol
LogP1.42
Rot. Bonds2

About N-(1,5-dimethylpyrazol-3-yl)-2-fluoro-2-methylpropanamide

N-(1,5-dimethylpyrazol-3-yl)-2-fluoro-2-methylpropanamide (PubChem CID 130165229) has the molecular formula C9H14FN3O and a molecular weight of 199.23 g/mol. Its IUPAC name is N-(1,5-dimethylpyrazol-3-yl)-2-fluoro-2-methylpropanamide.

Molecular Properties

Compound NameN-(1,5-dimethylpyrazol-3-yl)-2-fluoro-2-methylpropanamide
PubChem CID130165229
Molecular FormulaC9H14FN3O
Molecular Weight199.23 g/mol
Exact Mass199.11
IUPAC NameN-(1,5-dimethylpyrazol-3-yl)-2-fluoro-2-methylpropanamide
SMILESCc1cc(NC(=O)C(C)(C)F)nn1C
InChIInChI=1S/C9H14FN3O/c1-6-5-7(12-13(6)4)11-8(14)9(2,3)10/h5H,1-4H3,(H,11,12,14)
InChIKeyFEEKHVOCYPDLIV-UHFFFAOYSA-N
XLogP1.42
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.23
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(1,5-dimethylpyrazol-3-yl)-2-fluoro-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-(1,5-dimethylpyrazol-3-yl)-2-fluoro-2-methylpropanamide?
The IUPAC name of N-(1,5-dimethylpyrazol-3-yl)-2-fluoro-2-methylpropanamide (CID 130165229) is N-(1,5-dimethylpyrazol-3-yl)-2-fluoro-2-methylpropanamide.
What is the SMILES notation for N-(1,5-dimethylpyrazol-3-yl)-2-fluoro-2-methylpropanamide?
The canonical SMILES for N-(1,5-dimethylpyrazol-3-yl)-2-fluoro-2-methylpropanamide is Cc1cc(NC(=O)C(C)(C)F)nn1C.
What is the InChIKey of N-(1,5-dimethylpyrazol-3-yl)-2-fluoro-2-methylpropanamide?
The InChIKey is FEEKHVOCYPDLIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14FN3O/c1-6-5-7(12-13(6)4)11-8(14)9(2,3)10/h5H,1-4H3,(H,11,12,14).
What are the key properties of N-(1,5-dimethylpyrazol-3-yl)-2-fluoro-2-methylpropanamide?
N-(1,5-dimethylpyrazol-3-yl)-2-fluoro-2-methylpropanamide has a molecular weight of 199.23 g/mol, XLogP of 1.42, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,5-dimethylpyrazol-3-yl)-2-fluoro-2-methylpropanamide is sourced from PubChem (CID 130165229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).