2-hydroxy-5-iodo-N-(1-methylcyclobutyl)benzamide

C12H14INO2 — CID 103525844

IUPAC2-hydroxy-5-iodo-N-(1-methylcyclobutyl)benzamide
SMILESCC1(NC(=O)c2cc(I)ccc2O)CCC1
InChIInChI=1S/C12H14INO2/c1-12(5-2-6-12)14-11(16)9-7-8(13)3-4-10(9)15/h3-4,7,15H,2,5-6H2,1H3,(H,14,16)
InChIKeyZAEOSROVSSDZGK-UHFFFAOYSA-N
MW331.15 g/mol
LogP2.67
Rot. Bonds2

About 2-hydroxy-5-iodo-N-(1-methylcyclobutyl)benzamide

2-hydroxy-5-iodo-N-(1-methylcyclobutyl)benzamide (PubChem CID 103525844) has the molecular formula C12H14INO2 and a molecular weight of 331.15 g/mol. Its IUPAC name is 2-hydroxy-5-iodo-N-(1-methylcyclobutyl)benzamide.

Molecular Properties

Compound Name2-hydroxy-5-iodo-N-(1-methylcyclobutyl)benzamide
PubChem CID103525844
Molecular FormulaC12H14INO2
Molecular Weight331.15 g/mol
Exact Mass331.01
IUPAC Name2-hydroxy-5-iodo-N-(1-methylcyclobutyl)benzamide
SMILESCC1(NC(=O)c2cc(I)ccc2O)CCC1
InChIInChI=1S/C12H14INO2/c1-12(5-2-6-12)14-11(16)9-7-8(13)3-4-10(9)15/h3-4,7,15H,2,5-6H2,1H3,(H,14,16)
InChIKeyZAEOSROVSSDZGK-UHFFFAOYSA-N
XLogP2.67
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.15
LogP ≤ 52.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

Salicylamide
CID 5147
Salacetamide
CID 10252
Edasalonexent
CID 44626120
Benzamide, N,N'-1,6-hexanediylbis(2-hydroxy-
CID 209651
Salicylic acid ethanolamide
CID 90407
2-Hydroxy-N,N-dimethylbenzamide
CID 74500
N-Methylsalicylamide
CID 74624
2-hydroxy-N-(4-propylbenzoyl)benzamide
CID 2815186
Methylol salicylamide
CID 95698
2,3-Cresotamide
CID 26392
Triiodosalicylanilide
CID 203445
N-Benzyl-2-hydroxybenzamide
CID 561227

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-5-iodo-N-(1-methylcyclobutyl)benzamide?
The IUPAC name of 2-hydroxy-5-iodo-N-(1-methylcyclobutyl)benzamide (CID 103525844) is 2-hydroxy-5-iodo-N-(1-methylcyclobutyl)benzamide.
What is the SMILES notation for 2-hydroxy-5-iodo-N-(1-methylcyclobutyl)benzamide?
The canonical SMILES for 2-hydroxy-5-iodo-N-(1-methylcyclobutyl)benzamide is CC1(NC(=O)c2cc(I)ccc2O)CCC1.
What is the InChIKey of 2-hydroxy-5-iodo-N-(1-methylcyclobutyl)benzamide?
The InChIKey is ZAEOSROVSSDZGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14INO2/c1-12(5-2-6-12)14-11(16)9-7-8(13)3-4-10(9)15/h3-4,7,15H,2,5-6H2,1H3,(H,14,16).
What are the key properties of 2-hydroxy-5-iodo-N-(1-methylcyclobutyl)benzamide?
2-hydroxy-5-iodo-N-(1-methylcyclobutyl)benzamide has a molecular weight of 331.15 g/mol, XLogP of 2.67, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-5-iodo-N-(1-methylcyclobutyl)benzamide is sourced from PubChem (CID 103525844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).