1-(4-fluoroanilino)pyrazole-4-carboxamide

C10H9FN4O — CID 140650159

IUPAC1-(4-fluoroanilino)pyrazole-4-carboxamide
SMILESNC(=O)c1cnn(Nc2ccc(F)cc2)c1
InChIInChI=1S/C10H9FN4O/c11-8-1-3-9(4-2-8)14-15-6-7(5-13-15)10(12)16/h1-6,14H,(H2,12,16)
InChIKeyHQDXDQYDOFBVEM-UHFFFAOYSA-N
MW220.21 g/mol
LogP1.00
Rot. Bonds3

About 1-(4-fluoroanilino)pyrazole-4-carboxamide

1-(4-fluoroanilino)pyrazole-4-carboxamide (PubChem CID 140650159) has the molecular formula C10H9FN4O and a molecular weight of 220.21 g/mol. Its IUPAC name is 1-(4-fluoroanilino)pyrazole-4-carboxamide.

Molecular Properties

Compound Name1-(4-fluoroanilino)pyrazole-4-carboxamide
PubChem CID140650159
Molecular FormulaC10H9FN4O
Molecular Weight220.21 g/mol
Exact Mass220.08
IUPAC Name1-(4-fluoroanilino)pyrazole-4-carboxamide
SMILESNC(=O)c1cnn(Nc2ccc(F)cc2)c1
InChIInChI=1S/C10H9FN4O/c11-8-1-3-9(4-2-8)14-15-6-7(5-13-15)10(12)16/h1-6,14H,(H2,12,16)
InChIKeyHQDXDQYDOFBVEM-UHFFFAOYSA-N
XLogP1.00
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.21
LogP ≤ 51.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(4-fluoroanilino)pyrazole-4-carboxamide?
The IUPAC name of 1-(4-fluoroanilino)pyrazole-4-carboxamide (CID 140650159) is 1-(4-fluoroanilino)pyrazole-4-carboxamide.
What is the SMILES notation for 1-(4-fluoroanilino)pyrazole-4-carboxamide?
The canonical SMILES for 1-(4-fluoroanilino)pyrazole-4-carboxamide is NC(=O)c1cnn(Nc2ccc(F)cc2)c1.
What is the InChIKey of 1-(4-fluoroanilino)pyrazole-4-carboxamide?
The InChIKey is HQDXDQYDOFBVEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9FN4O/c11-8-1-3-9(4-2-8)14-15-6-7(5-13-15)10(12)16/h1-6,14H,(H2,12,16).
What are the key properties of 1-(4-fluoroanilino)pyrazole-4-carboxamide?
1-(4-fluoroanilino)pyrazole-4-carboxamide has a molecular weight of 220.21 g/mol, XLogP of 1.00, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluoroanilino)pyrazole-4-carboxamide is sourced from PubChem (CID 140650159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).