N-(5-chloro-2-methylphenyl)decanamide

C17H26ClNO — CID 5144260

IUPACN-(5-chloro-2-methylphenyl)decanamide
SMILESCCCCCCCCCC(=O)Nc1cc(Cl)ccc1C
InChIInChI=1S/C17H26ClNO/c1-3-4-5-6-7-8-9-10-17(20)19-16-13-15(18)12-11-14(16)2/h11-13H,3-10H2,1-2H3,(H,19,20)
InChIKeyQKYXRWYUAXDQCN-UHFFFAOYSA-N
MW295.85 g/mol
LogP5.73
Rot. Bonds9

About N-(5-chloro-2-methylphenyl)decanamide

N-(5-chloro-2-methylphenyl)decanamide (PubChem CID 5144260) has the molecular formula C17H26ClNO and a molecular weight of 295.85 g/mol. Its IUPAC name is N-(5-chloro-2-methylphenyl)decanamide.

Molecular Properties

Compound NameN-(5-chloro-2-methylphenyl)decanamide
PubChem CID5144260
Molecular FormulaC17H26ClNO
Molecular Weight295.85 g/mol
Exact Mass295.17
IUPAC NameN-(5-chloro-2-methylphenyl)decanamide
SMILESCCCCCCCCCC(=O)Nc1cc(Cl)ccc1C
InChIInChI=1S/C17H26ClNO/c1-3-4-5-6-7-8-9-10-17(20)19-16-13-15(18)12-11-14(16)2/h11-13H,3-10H2,1-2H3,(H,19,20)
InChIKeyQKYXRWYUAXDQCN-UHFFFAOYSA-N
XLogP5.73
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500295.85
LogP ≤ 55.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-(2,5-dichlorophenyl)heptanamide
CID 3294645
N-[2-(5-chloro-2-methylanilino)-2-oxoethyl]pentanamide
CID 112997994
N-(2,5-dichlorophenyl)hexanamide
CID 5055577
N-(5-chloro-2-methylphenyl)-4-(methylamino)butanamide
CID 60841323
N-(4-chloro-2-fluorophenyl)heptanamide
CID 4055752
N-(4-chloro-2-fluorophenyl)dodecanamide
CID 4598315
N-[(5-chloro-2-methylphenyl)carbamothioyl]pentanamide
CID 19187754
4-methyl-3-(octadecanoylamino)benzoic acid
CID 12800027
N-[3-[[2-(5-chloro-2-methylanilino)acetyl]amino]phenyl]hexanamide
CID 54819419
N,N'-bis(5-chloro-2-methylphenyl)propanediamide
CID 1340673
N-(2,5-dimethylphenyl)-4-oxo-4-(2-tetradecanoylhydrazinyl)butanamide
CID 54792025
N-(2-methyl-5-propan-2-ylphenyl)octanamide
CID 4069709

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-methylphenyl)decanamide?
The IUPAC name of N-(5-chloro-2-methylphenyl)decanamide (CID 5144260) is N-(5-chloro-2-methylphenyl)decanamide.
What is the SMILES notation for N-(5-chloro-2-methylphenyl)decanamide?
The canonical SMILES for N-(5-chloro-2-methylphenyl)decanamide is CCCCCCCCCC(=O)Nc1cc(Cl)ccc1C.
What is the InChIKey of N-(5-chloro-2-methylphenyl)decanamide?
The InChIKey is QKYXRWYUAXDQCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26ClNO/c1-3-4-5-6-7-8-9-10-17(20)19-16-13-15(18)12-11-14(16)2/h11-13H,3-10H2,1-2H3,(H,19,20).
What are the key properties of N-(5-chloro-2-methylphenyl)decanamide?
N-(5-chloro-2-methylphenyl)decanamide has a molecular weight of 295.85 g/mol, XLogP of 5.73, 9 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-methylphenyl)decanamide is sourced from PubChem (CID 5144260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).