2,6-difluoro-N-(1H-pyrazol-5-yl)benzamide

C10H7F2N3O — CID 59547942

IUPAC2,6-difluoro-N-(1H-pyrazol-5-yl)benzamide
SMILESO=C(Nc1ccn[nH]1)c1c(F)cccc1F
InChIInChI=1S/C10H7F2N3O/c11-6-2-1-3-7(12)9(6)10(16)14-8-4-5-13-15-8/h1-5H,(H2,13,14,15,16)
InChIKeyUMBVHXNGQIFPCN-UHFFFAOYSA-N
MW223.18 g/mol
LogP1.94
Rot. Bonds2

About 2,6-difluoro-N-(1H-pyrazol-5-yl)benzamide

2,6-difluoro-N-(1H-pyrazol-5-yl)benzamide (PubChem CID 59547942) has the molecular formula C10H7F2N3O and a molecular weight of 223.18 g/mol. Its IUPAC name is 2,6-difluoro-N-(1H-pyrazol-5-yl)benzamide.

Molecular Properties

Compound Name2,6-difluoro-N-(1H-pyrazol-5-yl)benzamide
PubChem CID59547942
Molecular FormulaC10H7F2N3O
Molecular Weight223.18 g/mol
Exact Mass223.06
IUPAC Name2,6-difluoro-N-(1H-pyrazol-5-yl)benzamide
SMILESO=C(Nc1ccn[nH]1)c1c(F)cccc1F
InChIInChI=1S/C10H7F2N3O/c11-6-2-1-3-7(12)9(6)10(16)14-8-4-5-13-15-8/h1-5H,(H2,13,14,15,16)
InChIKeyUMBVHXNGQIFPCN-UHFFFAOYSA-N
XLogP1.94
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.18
LogP ≤ 51.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,6-difluoro-N-(1H-pyrazol-5-yl)benzamide?
The IUPAC name of 2,6-difluoro-N-(1H-pyrazol-5-yl)benzamide (CID 59547942) is 2,6-difluoro-N-(1H-pyrazol-5-yl)benzamide.
What is the SMILES notation for 2,6-difluoro-N-(1H-pyrazol-5-yl)benzamide?
The canonical SMILES for 2,6-difluoro-N-(1H-pyrazol-5-yl)benzamide is O=C(Nc1ccn[nH]1)c1c(F)cccc1F.
What is the InChIKey of 2,6-difluoro-N-(1H-pyrazol-5-yl)benzamide?
The InChIKey is UMBVHXNGQIFPCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7F2N3O/c11-6-2-1-3-7(12)9(6)10(16)14-8-4-5-13-15-8/h1-5H,(H2,13,14,15,16).
What are the key properties of 2,6-difluoro-N-(1H-pyrazol-5-yl)benzamide?
2,6-difluoro-N-(1H-pyrazol-5-yl)benzamide has a molecular weight of 223.18 g/mol, XLogP of 1.94, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-difluoro-N-(1H-pyrazol-5-yl)benzamide is sourced from PubChem (CID 59547942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).