2-hydroxy-5-iodo-N-(1H-pyrazol-5-yl)benzamide

C10H8IN3O2 — CID 103710669

IUPAC2-hydroxy-5-iodo-N-(1H-pyrazol-5-yl)benzamide
SMILESO=C(Nc1ccn[nH]1)c1cc(I)ccc1O
InChIInChI=1S/C10H8IN3O2/c11-6-1-2-8(15)7(5-6)10(16)13-9-3-4-12-14-9/h1-5,15H,(H2,12,13,14,16)
InChIKeyXKVLNCNGYJQAFI-UHFFFAOYSA-N
MW329.10 g/mol
LogP1.97
Rot. Bonds2

About 2-hydroxy-5-iodo-N-(1H-pyrazol-5-yl)benzamide

2-hydroxy-5-iodo-N-(1H-pyrazol-5-yl)benzamide (PubChem CID 103710669) has the molecular formula C10H8IN3O2 and a molecular weight of 329.10 g/mol. Its IUPAC name is 2-hydroxy-5-iodo-N-(1H-pyrazol-5-yl)benzamide.

Molecular Properties

Compound Name2-hydroxy-5-iodo-N-(1H-pyrazol-5-yl)benzamide
PubChem CID103710669
Molecular FormulaC10H8IN3O2
Molecular Weight329.10 g/mol
Exact Mass328.97
IUPAC Name2-hydroxy-5-iodo-N-(1H-pyrazol-5-yl)benzamide
SMILESO=C(Nc1ccn[nH]1)c1cc(I)ccc1O
InChIInChI=1S/C10H8IN3O2/c11-6-1-2-8(15)7(5-6)10(16)13-9-3-4-12-14-9/h1-5,15H,(H2,12,13,14,16)
InChIKeyXKVLNCNGYJQAFI-UHFFFAOYSA-N
XLogP1.97
TPSA78.01 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.10
LogP ≤ 51.97
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

3,4-dihydroxy-N-(1H-pyrazol-5-yl)benzamide
CID 103956763
4-fluoro-2-hydroxy-N-(1H-pyrazol-5-yl)benzamide
CID 103829854
2-iodo-N-(1H-pyrazol-5-yl)benzamide
CID 61393108
N-(4-ethyl-1H-pyrazol-5-yl)-2-hydroxy-5-iodobenzamide
CID 103524810
N-(4-carbamothioylphenyl)-2-hydroxy-5-iodobenzamide
CID 107731512
2-hydroxy-5-iodo-N-(4-iodo-2-methylphenyl)benzamide
CID 86251688
5-chloro-4-iodo-2-methoxy-N-(1H-pyrazol-5-yl)benzamide
CID 61394014
N-(3-chlorophenyl)-2-hydroxy-5-iodobenzamide
CID 103602012
5-iodo-2-(1H-pyrazole-5-carbonylamino)benzoic acid
CID 63111258
2,4-difluoro-6-hydroxy-N-(1H-pyrazol-5-yl)benzamide
CID 47466440
N-(4-bromo-2-chlorophenyl)-2-hydroxy-5-iodobenzamide
CID 107731654
N-(1H-pyrazol-5-yl)benzamide
CID 23298723

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-5-iodo-N-(1H-pyrazol-5-yl)benzamide?
The IUPAC name of 2-hydroxy-5-iodo-N-(1H-pyrazol-5-yl)benzamide (CID 103710669) is 2-hydroxy-5-iodo-N-(1H-pyrazol-5-yl)benzamide.
What is the SMILES notation for 2-hydroxy-5-iodo-N-(1H-pyrazol-5-yl)benzamide?
The canonical SMILES for 2-hydroxy-5-iodo-N-(1H-pyrazol-5-yl)benzamide is O=C(Nc1ccn[nH]1)c1cc(I)ccc1O.
What is the InChIKey of 2-hydroxy-5-iodo-N-(1H-pyrazol-5-yl)benzamide?
The InChIKey is XKVLNCNGYJQAFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8IN3O2/c11-6-1-2-8(15)7(5-6)10(16)13-9-3-4-12-14-9/h1-5,15H,(H2,12,13,14,16).
What are the key properties of 2-hydroxy-5-iodo-N-(1H-pyrazol-5-yl)benzamide?
2-hydroxy-5-iodo-N-(1H-pyrazol-5-yl)benzamide has a molecular weight of 329.10 g/mol, XLogP of 1.97, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-5-iodo-N-(1H-pyrazol-5-yl)benzamide is sourced from PubChem (CID 103710669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).