N-hydroxy-N-iodopentacosanamide

C25H50INO2 — CID 87683036

IUPACN-hydroxy-N-iodopentacosanamide
SMILESCCCCCCCCCCCCCCCCCCCCCCCCC(=O)N(O)I
InChIInChI=1S/C25H50INO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25(28)27(26)29/h29H,2-24H2,1H3
InChIKeyPWCVISMHKIFPJK-UHFFFAOYSA-N
MW523.58 g/mol
LogP9.55
Rot. Bonds23

About N-hydroxy-N-iodopentacosanamide

N-hydroxy-N-iodopentacosanamide (PubChem CID 87683036) has the molecular formula C25H50INO2 and a molecular weight of 523.58 g/mol. Its IUPAC name is N-hydroxy-N-iodopentacosanamide.

Molecular Properties

Compound NameN-hydroxy-N-iodopentacosanamide
PubChem CID87683036
Molecular FormulaC25H50INO2
Molecular Weight523.58 g/mol
Exact Mass523.29
IUPAC NameN-hydroxy-N-iodopentacosanamide
SMILESCCCCCCCCCCCCCCCCCCCCCCCCC(=O)N(O)I
InChIInChI=1S/C25H50INO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25(28)27(26)29/h29H,2-24H2,1H3
InChIKeyPWCVISMHKIFPJK-UHFFFAOYSA-N
XLogP9.55
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds23
Heavy Atoms29
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500523.58
LogP ≤ 59.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}, {'alert_name': 'N-halo', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-hydroxy-N-methyloctadecanamide
CID 19818891
N-chloro-N-hydroxyhentriacontanamide
CID 87683958
N-amino-N-hydroxydocosanamide
CID 87686885
N-bromo-N-hydroxyheptatriacontanamide
CID 87686971
N-hexadecyl-N-hydroxyoctadecanamide
CID 150697655
N-bromo-N-hydroxytetradecanamide
CID 87684693
N-bromo-N-hydroxynonacosanamide
CID 87682957
N-decanoyl-N-methyldecanamide
CID 141076390
N,N-dimethyldecanamide;N,N-dimethyloctanamide
CID 155099591
N-[2-[di(hexadecanoyl)amino]ethyl]-N-octadecanoyloctadecanamide
CID 88723391
N,N-dimethyloctadecanamide;hydrobromide
CID 174406080
N,N-dimethyldodecanamide;hydrochloride
CID 173149987

Frequently Asked Questions

What is the IUPAC name of N-hydroxy-N-iodopentacosanamide?
The IUPAC name of N-hydroxy-N-iodopentacosanamide (CID 87683036) is N-hydroxy-N-iodopentacosanamide.
What is the SMILES notation for N-hydroxy-N-iodopentacosanamide?
The canonical SMILES for N-hydroxy-N-iodopentacosanamide is CCCCCCCCCCCCCCCCCCCCCCCCC(=O)N(O)I.
What is the InChIKey of N-hydroxy-N-iodopentacosanamide?
The InChIKey is PWCVISMHKIFPJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H50INO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25(28)27(26)29/h29H,2-24H2,1H3.
What are the key properties of N-hydroxy-N-iodopentacosanamide?
N-hydroxy-N-iodopentacosanamide has a molecular weight of 523.58 g/mol, XLogP of 9.55, 23 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-N-iodopentacosanamide is sourced from PubChem (CID 87683036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).