N-(3,5-dichloro-2-hydroxyphenyl)decanamide

C16H23Cl2NO2 — CID 107675883

IUPACN-(3,5-dichloro-2-hydroxyphenyl)decanamide
SMILESCCCCCCCCCC(=O)Nc1cc(Cl)cc(Cl)c1O
InChIInChI=1S/C16H23Cl2NO2/c1-2-3-4-5-6-7-8-9-15(20)19-14-11-12(17)10-13(18)16(14)21/h10-11,21H,2-9H2,1H3,(H,19,20)
InChIKeyCQGXJZMCYRTKNZ-UHFFFAOYSA-N
MW332.27 g/mol
LogP5.78
Rot. Bonds9

About N-(3,5-dichloro-2-hydroxyphenyl)decanamide

N-(3,5-dichloro-2-hydroxyphenyl)decanamide (PubChem CID 107675883) has the molecular formula C16H23Cl2NO2 and a molecular weight of 332.27 g/mol. Its IUPAC name is N-(3,5-dichloro-2-hydroxyphenyl)decanamide.

Molecular Properties

Compound NameN-(3,5-dichloro-2-hydroxyphenyl)decanamide
PubChem CID107675883
Molecular FormulaC16H23Cl2NO2
Molecular Weight332.27 g/mol
Exact Mass331.11
IUPAC NameN-(3,5-dichloro-2-hydroxyphenyl)decanamide
SMILESCCCCCCCCCC(=O)Nc1cc(Cl)cc(Cl)c1O
InChIInChI=1S/C16H23Cl2NO2/c1-2-3-4-5-6-7-8-9-15(20)19-14-11-12(17)10-13(18)16(14)21/h10-11,21H,2-9H2,1H3,(H,19,20)
InChIKeyCQGXJZMCYRTKNZ-UHFFFAOYSA-N
XLogP5.78
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500332.27
LogP ≤ 55.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(3,5-dichloro-2-hydroxyphenyl)pentanamide
CID 103891119
N-(3,5-dichloro-2-hydroxyphenyl)-4-ethoxybutanamide
CID 103891151
N-(2,5-dichlorophenyl)heptanamide
CID 3294645
N-(3,5-dichloro-2-hydroxy-4-methylphenyl)octadecanamide
CID 154397523
N-(2,5-dichlorophenyl)hexanamide
CID 5055577
N-(2,5-dichloro-3-formylphenyl)dodecanamide
CID 54437397
N-(3,5-dichlorophenyl)nonanamide
CID 3459184
N-(5-chloro-2-methylphenyl)decanamide
CID 5144260
N-(2-chloro-4-hydroxyphenyl)nonanamide
CID 65427497
N-(3,5-dichloro-2-hydroxyphenyl)-4,4,4-trifluorobutanamide
CID 104625918
3,5-dichloro-2-(octanoylamino)benzoic acid
CID 43331454
N-(2-chlorophenyl)octanamide
CID 2292983

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dichloro-2-hydroxyphenyl)decanamide?
The IUPAC name of N-(3,5-dichloro-2-hydroxyphenyl)decanamide (CID 107675883) is N-(3,5-dichloro-2-hydroxyphenyl)decanamide.
What is the SMILES notation for N-(3,5-dichloro-2-hydroxyphenyl)decanamide?
The canonical SMILES for N-(3,5-dichloro-2-hydroxyphenyl)decanamide is CCCCCCCCCC(=O)Nc1cc(Cl)cc(Cl)c1O.
What is the InChIKey of N-(3,5-dichloro-2-hydroxyphenyl)decanamide?
The InChIKey is CQGXJZMCYRTKNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23Cl2NO2/c1-2-3-4-5-6-7-8-9-15(20)19-14-11-12(17)10-13(18)16(14)21/h10-11,21H,2-9H2,1H3,(H,19,20).
What are the key properties of N-(3,5-dichloro-2-hydroxyphenyl)decanamide?
N-(3,5-dichloro-2-hydroxyphenyl)decanamide has a molecular weight of 332.27 g/mol, XLogP of 5.78, 9 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dichloro-2-hydroxyphenyl)decanamide is sourced from PubChem (CID 107675883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).