N-(2,5-dichlorophenyl)hexanamide

C12H15Cl2NO — CID 5055577

IUPACN-(2,5-dichlorophenyl)hexanamide
SMILESCCCCCC(=O)Nc1cc(Cl)ccc1Cl
InChIInChI=1S/C12H15Cl2NO/c1-2-3-4-5-12(16)15-11-8-9(13)6-7-10(11)14/h6-8H,2-5H2,1H3,(H,15,16)
InChIKeyFXHARCOSSIOJOS-UHFFFAOYSA-N
MW260.16 g/mol
LogP4.51
Rot. Bonds5

About N-(2,5-dichlorophenyl)hexanamide

N-(2,5-dichlorophenyl)hexanamide (PubChem CID 5055577) has the molecular formula C12H15Cl2NO and a molecular weight of 260.16 g/mol. Its IUPAC name is N-(2,5-dichlorophenyl)hexanamide.

Molecular Properties

Compound NameN-(2,5-dichlorophenyl)hexanamide
PubChem CID5055577
Molecular FormulaC12H15Cl2NO
Molecular Weight260.16 g/mol
Exact Mass259.05
IUPAC NameN-(2,5-dichlorophenyl)hexanamide
SMILESCCCCCC(=O)Nc1cc(Cl)ccc1Cl
InChIInChI=1S/C12H15Cl2NO/c1-2-3-4-5-12(16)15-11-8-9(13)6-7-10(11)14/h6-8H,2-5H2,1H3,(H,15,16)
InChIKeyFXHARCOSSIOJOS-UHFFFAOYSA-N
XLogP4.51
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.16
LogP ≤ 54.51
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-(5-chloro-2-methylphenyl)decanamide
CID 5144260
6-amino-N-(2,5-dichlorophenyl)hexanamide
CID 24694210
5-(2,5-dichloroanilino)-5-oxopentanoic acid
CID 3516353
N-(5-acetamido-2-chlorophenyl)octanamide
CID 60538690
N-(4-chloro-2-fluorophenyl)dodecanamide
CID 4598315
N-(4-chloro-2-fluorophenyl)heptanamide
CID 4055752
N-[2-(2,5-dichloroanilino)-2-oxoethyl]-N-propylhexanamide
CID 55328661
N-(5-chloro-2-cyanophenyl)hexanamide
CID 60628682
N-(2-chlorophenyl)hexanamide
CID 4644560
N-(2,5-dichlorophenyl)-3-(dipropylamino)propanamide
CID 52579958
N-(2,5-dichlorophenyl)-3-hydroxypropanamide
CID 43558723

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dichlorophenyl)hexanamide?
The IUPAC name of N-(2,5-dichlorophenyl)hexanamide (CID 5055577) is N-(2,5-dichlorophenyl)hexanamide.
What is the SMILES notation for N-(2,5-dichlorophenyl)hexanamide?
The canonical SMILES for N-(2,5-dichlorophenyl)hexanamide is CCCCCC(=O)Nc1cc(Cl)ccc1Cl.
What is the InChIKey of N-(2,5-dichlorophenyl)hexanamide?
The InChIKey is FXHARCOSSIOJOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15Cl2NO/c1-2-3-4-5-12(16)15-11-8-9(13)6-7-10(11)14/h6-8H,2-5H2,1H3,(H,15,16).
What are the key properties of N-(2,5-dichlorophenyl)hexanamide?
N-(2,5-dichlorophenyl)hexanamide has a molecular weight of 260.16 g/mol, XLogP of 4.51, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dichlorophenyl)hexanamide is sourced from PubChem (CID 5055577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).