3-amino-N-(4-bromo-2-fluorophenyl)-1H-pyrazole-5-carboxamide

C10H8BrFN4O — CID 64525794

IUPAC3-amino-N-(4-bromo-2-fluorophenyl)-1H-pyrazole-5-carboxamide
SMILESNc1cc(C(=O)Nc2ccc(Br)cc2F)[nH]n1
InChIInChI=1S/C10H8BrFN4O/c11-5-1-2-7(6(12)3-5)14-10(17)8-4-9(13)16-15-8/h1-4H,(H,14,17)(H3,13,15,16)
InChIKeyYYBHIIPFELXJQR-UHFFFAOYSA-N
MW299.10 g/mol
LogP2.15
Rot. Bonds2

About 3-amino-N-(4-bromo-2-fluorophenyl)-1H-pyrazole-5-carboxamide

3-amino-N-(4-bromo-2-fluorophenyl)-1H-pyrazole-5-carboxamide (PubChem CID 64525794) has the molecular formula C10H8BrFN4O and a molecular weight of 299.10 g/mol. Its IUPAC name is 3-amino-N-(4-bromo-2-fluorophenyl)-1H-pyrazole-5-carboxamide.

Molecular Properties

Compound Name3-amino-N-(4-bromo-2-fluorophenyl)-1H-pyrazole-5-carboxamide
PubChem CID64525794
Molecular FormulaC10H8BrFN4O
Molecular Weight299.10 g/mol
Exact Mass297.99
IUPAC Name3-amino-N-(4-bromo-2-fluorophenyl)-1H-pyrazole-5-carboxamide
SMILESNc1cc(C(=O)Nc2ccc(Br)cc2F)[nH]n1
InChIInChI=1S/C10H8BrFN4O/c11-5-1-2-7(6(12)3-5)14-10(17)8-4-9(13)16-15-8/h1-4H,(H,14,17)(H3,13,15,16)
InChIKeyYYBHIIPFELXJQR-UHFFFAOYSA-N
XLogP2.15
TPSA83.80 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.10
LogP ≤ 52.15
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 3-amino-N-(4-bromo-2-fluorophenyl)-1H-pyrazole-5-carboxamide with MolForge

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

Launch Full Analysis

Related Compounds

3-amino-N-(2-fluoro-5-methylphenyl)-1H-pyrazole-5-carboxamide
CID 64524613
2-amino-N-(4-bromo-2-fluorophenyl)pyridine-4-carboxamide
CID 62151121
3-amino-N-(4-fluoro-2-methoxyphenyl)-1H-pyrazole-5-carboxamide
CID 64525066
4-bromo-N-(4-bromo-2-fluorophenyl)-1H-pyrazole-5-carboxamide
CID 19511226
3-amino-N-(2-bromo-4-cyanophenyl)-1H-pyrazole-5-carboxamide
CID 107796825
5-amino-N-(4-bromo-2-fluorophenyl)-2,4-difluorobenzamide
CID 61090845
3-amino-N-(3-chloro-2-fluorophenyl)-1H-pyrazole-5-carboxamide
CID 64524808
N-(4-bromo-2-fluorophenyl)-1H-pyrazole-4-carboxamide
CID 43532914
N-(4-bromo-2-fluorophenyl)-5-hydrazinylpyridine-2-carboxamide
CID 104642173
3-amino-N-(4-bromo-2,6-dimethylphenyl)-1H-pyrazole-5-carboxamide
CID 64523433
5-amino-N-(4-bromo-2-fluorophenyl)-2,4-dimethylbenzamide
CID 102704921
N-(4-bromo-2-fluorophenyl)pyridazine-4-carboxamide
CID 112702158

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(4-bromo-2-fluorophenyl)-1H-pyrazole-5-carboxamide?
The IUPAC name of 3-amino-N-(4-bromo-2-fluorophenyl)-1H-pyrazole-5-carboxamide (CID 64525794) is 3-amino-N-(4-bromo-2-fluorophenyl)-1H-pyrazole-5-carboxamide.
What is the SMILES notation for 3-amino-N-(4-bromo-2-fluorophenyl)-1H-pyrazole-5-carboxamide?
The canonical SMILES for 3-amino-N-(4-bromo-2-fluorophenyl)-1H-pyrazole-5-carboxamide is Nc1cc(C(=O)Nc2ccc(Br)cc2F)[nH]n1.
What is the InChIKey of 3-amino-N-(4-bromo-2-fluorophenyl)-1H-pyrazole-5-carboxamide?
The InChIKey is YYBHIIPFELXJQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8BrFN4O/c11-5-1-2-7(6(12)3-5)14-10(17)8-4-9(13)16-15-8/h1-4H,(H,14,17)(H3,13,15,16).
What are the key properties of 3-amino-N-(4-bromo-2-fluorophenyl)-1H-pyrazole-5-carboxamide?
3-amino-N-(4-bromo-2-fluorophenyl)-1H-pyrazole-5-carboxamide has a molecular weight of 299.10 g/mol, XLogP of 2.15, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(4-bromo-2-fluorophenyl)-1H-pyrazole-5-carboxamide is sourced from PubChem (CID 64525794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).