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

C10H9FN4O — CID 43159548

IUPAC5-amino-N-(3-fluorophenyl)-1H-pyrazole-4-carboxamide
SMILESNc1[nH]ncc1C(=O)Nc1cccc(F)c1
InChIInChI=1S/C10H9FN4O/c11-6-2-1-3-7(4-6)14-10(16)8-5-13-15-9(8)12/h1-5H,(H,14,16)(H3,12,13,15)
InChIKeyCUSMYUWAMCRUAK-UHFFFAOYSA-N
MW220.21 g/mol
LogP1.38
Rot. Bonds2

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

5-amino-N-(3-fluorophenyl)-1H-pyrazole-4-carboxamide (PubChem CID 43159548) has the molecular formula C10H9FN4O and a molecular weight of 220.21 g/mol. Its IUPAC name is 5-amino-N-(3-fluorophenyl)-1H-pyrazole-4-carboxamide.

Molecular Properties

Compound Name5-amino-N-(3-fluorophenyl)-1H-pyrazole-4-carboxamide
PubChem CID43159548
Molecular FormulaC10H9FN4O
Molecular Weight220.21 g/mol
Exact Mass220.08
IUPAC Name5-amino-N-(3-fluorophenyl)-1H-pyrazole-4-carboxamide
SMILESNc1[nH]ncc1C(=O)Nc1cccc(F)c1
InChIInChI=1S/C10H9FN4O/c11-6-2-1-3-7(4-6)14-10(16)8-5-13-15-9(8)12/h1-5H,(H,14,16)(H3,12,13,15)
InChIKeyCUSMYUWAMCRUAK-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

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Frequently Asked Questions

What is the IUPAC name of 5-amino-N-(3-fluorophenyl)-1H-pyrazole-4-carboxamide?
The IUPAC name of 5-amino-N-(3-fluorophenyl)-1H-pyrazole-4-carboxamide (CID 43159548) is 5-amino-N-(3-fluorophenyl)-1H-pyrazole-4-carboxamide.
What is the SMILES notation for 5-amino-N-(3-fluorophenyl)-1H-pyrazole-4-carboxamide?
The canonical SMILES for 5-amino-N-(3-fluorophenyl)-1H-pyrazole-4-carboxamide is Nc1[nH]ncc1C(=O)Nc1cccc(F)c1.
What is the InChIKey of 5-amino-N-(3-fluorophenyl)-1H-pyrazole-4-carboxamide?
The InChIKey is CUSMYUWAMCRUAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9FN4O/c11-6-2-1-3-7(4-6)14-10(16)8-5-13-15-9(8)12/h1-5H,(H,14,16)(H3,12,13,15).
What are the key properties of 5-amino-N-(3-fluorophenyl)-1H-pyrazole-4-carboxamide?
5-amino-N-(3-fluorophenyl)-1H-pyrazole-4-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 5-amino-N-(3-fluorophenyl)-1H-pyrazole-4-carboxamide is sourced from PubChem (CID 43159548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).