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

C10H9FN4O — CID 63257543

IUPACN-(2-amino-5-fluorophenyl)-1H-pyrazole-5-carboxamide
SMILESNc1ccc(F)cc1NC(=O)c1ccn[nH]1
InChIInChI=1S/C10H9FN4O/c11-6-1-2-7(12)9(5-6)14-10(16)8-3-4-13-15-8/h1-5H,12H2,(H,13,15)(H,14,16)
InChIKeyVIMLOQPIBRRCQZ-UHFFFAOYSA-N
MW220.21 g/mol
LogP1.38
Rot. Bonds2

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

N-(2-amino-5-fluorophenyl)-1H-pyrazole-5-carboxamide (PubChem CID 63257543) has the molecular formula C10H9FN4O and a molecular weight of 220.21 g/mol. Its IUPAC name is N-(2-amino-5-fluorophenyl)-1H-pyrazole-5-carboxamide.

Molecular Properties

Compound NameN-(2-amino-5-fluorophenyl)-1H-pyrazole-5-carboxamide
PubChem CID63257543
Molecular FormulaC10H9FN4O
Molecular Weight220.21 g/mol
Exact Mass220.08
IUPAC NameN-(2-amino-5-fluorophenyl)-1H-pyrazole-5-carboxamide
SMILESNc1ccc(F)cc1NC(=O)c1ccn[nH]1
InChIInChI=1S/C10H9FN4O/c11-6-1-2-7(12)9(5-6)14-10(16)8-3-4-13-15-8/h1-5H,12H2,(H,13,15)(H,14,16)
InChIKeyVIMLOQPIBRRCQZ-UHFFFAOYSA-N
XLogP1.38
TPSA83.80 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.21
LogP ≤ 51.38
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

N-(4-fluoro-2-methylphenyl)-1H-pyrazole-5-carboxamide
CID 47177432
N-(2-amino-5-fluorophenyl)-2,4-dioxo-1H-pyrimidine-6-carboxamide
CID 63257428
N-(8-aminoquinolin-5-yl)-1H-pyrazole-5-carboxamide
CID 104826490
N-(2-amino-5-fluorophenyl)-5-fluoro-2-hydroxybenzamide
CID 115298392
N-(2-amino-5-fluorophenyl)-2,4,6-trimethylbenzamide
CID 63257510
N-(2,4-dichlorophenyl)-1H-pyrazole-5-carboxamide
CID 68952080
N-(2-amino-5-fluorophenyl)-5-chloro-2-fluorobenzamide
CID 63257209
3-fluoro-4-(1H-pyrazole-5-carbonylamino)benzenesulfonyl chloride
CID 63086288
N-(2-amino-5-fluorophenyl)-2-chlorofuran-3-carboxamide
CID 106683261
2-amino-N-(2-amino-5-fluorophenyl)acetamide
CID 110477650
N-(5-chloro-2-hydroxyphenyl)-1H-pyrazole-5-carboxamide
CID 16678665
N-(5-bromo-2-chlorophenyl)-1H-pyrazole-5-carboxamide
CID 55208813

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-5-fluorophenyl)-1H-pyrazole-5-carboxamide?
The IUPAC name of N-(2-amino-5-fluorophenyl)-1H-pyrazole-5-carboxamide (CID 63257543) is N-(2-amino-5-fluorophenyl)-1H-pyrazole-5-carboxamide.
What is the SMILES notation for N-(2-amino-5-fluorophenyl)-1H-pyrazole-5-carboxamide?
The canonical SMILES for N-(2-amino-5-fluorophenyl)-1H-pyrazole-5-carboxamide is Nc1ccc(F)cc1NC(=O)c1ccn[nH]1.
What is the InChIKey of N-(2-amino-5-fluorophenyl)-1H-pyrazole-5-carboxamide?
The InChIKey is VIMLOQPIBRRCQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9FN4O/c11-6-1-2-7(12)9(5-6)14-10(16)8-3-4-13-15-8/h1-5H,12H2,(H,13,15)(H,14,16).
What are the key properties of N-(2-amino-5-fluorophenyl)-1H-pyrazole-5-carboxamide?
N-(2-amino-5-fluorophenyl)-1H-pyrazole-5-carboxamide has a molecular weight of 220.21 g/mol, XLogP of 1.38, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-5-fluorophenyl)-1H-pyrazole-5-carboxamide is sourced from PubChem (CID 63257543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).