5-(2-fluorophenyl)-1H-pyrazole-4-carboxamide

C10H8FN3O — CID 171539156

IUPAC5-(2-fluorophenyl)-1H-pyrazole-4-carboxamide
SMILESNC(=O)c1cn[nH]c1-c1ccccc1F
InChIInChI=1S/C10H8FN3O/c11-8-4-2-1-3-6(8)9-7(10(12)15)5-13-14-9/h1-5H,(H2,12,15)(H,13,14)
InChIKeyLHSGVASRZGCOPX-UHFFFAOYSA-N
MW205.19 g/mol
LogP1.31
Rot. Bonds2

About 5-(2-fluorophenyl)-1H-pyrazole-4-carboxamide

5-(2-fluorophenyl)-1H-pyrazole-4-carboxamide (PubChem CID 171539156) has the molecular formula C10H8FN3O and a molecular weight of 205.19 g/mol. Its IUPAC name is 5-(2-fluorophenyl)-1H-pyrazole-4-carboxamide.

Molecular Properties

Compound Name5-(2-fluorophenyl)-1H-pyrazole-4-carboxamide
PubChem CID171539156
Molecular FormulaC10H8FN3O
Molecular Weight205.19 g/mol
Exact Mass205.07
IUPAC Name5-(2-fluorophenyl)-1H-pyrazole-4-carboxamide
SMILESNC(=O)c1cn[nH]c1-c1ccccc1F
InChIInChI=1S/C10H8FN3O/c11-8-4-2-1-3-6(8)9-7(10(12)15)5-13-14-9/h1-5H,(H2,12,15)(H,13,14)
InChIKeyLHSGVASRZGCOPX-UHFFFAOYSA-N
XLogP1.31
TPSA71.77 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.19
LogP ≤ 51.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-phenyl-1H-pyrazole-4-carbaldehyde
CID 291816
3-(4-Fluorophenyl)-1H-pyrazole-4-carboxaldehyde
CID 605439
3-(4-Chlorophenyl)-1H-pyrazole-4-carbaldehyde
CID 609912
3-(4-fluorophenyl)-1H-pyrazole-4-carboxylic acid
CID 3465472
3-phenyl-1H-pyrazole-4-carboxylic acid
CID 4138562
3-(4-bromophenyl)-1H-pyrazole-4-carbaldehyde
CID 776542
1H-Indazole-7-carboxamide
CID 44586040
5-(3-methylphenyl)-1H-pyrazole-4-carbaldehyde
CID 9430043
3-(3-fluorophenyl)-1H-pyrazole-4-carbaldehyde
CID 1417885
3-(4-Methylphenyl)-1H-pyrazole-4-carboxaldehyde
CID 2760667
6-Phenyl-1,5,6,7-tetrahydroindazol-4-one
CID 6458957
3-(3-bromophenyl)-1H-pyrazole-4-carbaldehyde
CID 4201982

Frequently Asked Questions

What is the IUPAC name of 5-(2-fluorophenyl)-1H-pyrazole-4-carboxamide?
The IUPAC name of 5-(2-fluorophenyl)-1H-pyrazole-4-carboxamide (CID 171539156) is 5-(2-fluorophenyl)-1H-pyrazole-4-carboxamide.
What is the SMILES notation for 5-(2-fluorophenyl)-1H-pyrazole-4-carboxamide?
The canonical SMILES for 5-(2-fluorophenyl)-1H-pyrazole-4-carboxamide is NC(=O)c1cn[nH]c1-c1ccccc1F.
What is the InChIKey of 5-(2-fluorophenyl)-1H-pyrazole-4-carboxamide?
The InChIKey is LHSGVASRZGCOPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8FN3O/c11-8-4-2-1-3-6(8)9-7(10(12)15)5-13-14-9/h1-5H,(H2,12,15)(H,13,14).
What are the key properties of 5-(2-fluorophenyl)-1H-pyrazole-4-carboxamide?
5-(2-fluorophenyl)-1H-pyrazole-4-carboxamide has a molecular weight of 205.19 g/mol, XLogP of 1.31, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-fluorophenyl)-1H-pyrazole-4-carboxamide is sourced from PubChem (CID 171539156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).