6-amino-N-(2,5-dichlorophenyl)hexanamide

C12H16Cl2N2O — CID 24694210

IUPAC6-amino-N-(2,5-dichlorophenyl)hexanamide
SMILESNCCCCCC(=O)Nc1cc(Cl)ccc1Cl
InChIInChI=1S/C12H16Cl2N2O/c13-9-5-6-10(14)11(8-9)16-12(17)4-2-1-3-7-15/h5-6,8H,1-4,7,15H2,(H,16,17)
InChIKeyNYYUDXWCEIKFAE-UHFFFAOYSA-N
MW275.18 g/mol
LogP3.45
Rot. Bonds6

About 6-amino-N-(2,5-dichlorophenyl)hexanamide

6-amino-N-(2,5-dichlorophenyl)hexanamide (PubChem CID 24694210) has the molecular formula C12H16Cl2N2O and a molecular weight of 275.18 g/mol. Its IUPAC name is 6-amino-N-(2,5-dichlorophenyl)hexanamide.

Molecular Properties

Compound Name6-amino-N-(2,5-dichlorophenyl)hexanamide
PubChem CID24694210
Molecular FormulaC12H16Cl2N2O
Molecular Weight275.18 g/mol
Exact Mass274.06
IUPAC Name6-amino-N-(2,5-dichlorophenyl)hexanamide
SMILESNCCCCCC(=O)Nc1cc(Cl)ccc1Cl
InChIInChI=1S/C12H16Cl2N2O/c13-9-5-6-10(14)11(8-9)16-12(17)4-2-1-3-7-15/h5-6,8H,1-4,7,15H2,(H,16,17)
InChIKeyNYYUDXWCEIKFAE-UHFFFAOYSA-N
XLogP3.45
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.18
LogP ≤ 53.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 6-amino-N-(2,5-dichlorophenyl)hexanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2,5-dichlorophenyl)heptanamide
CID 3294645
N-(2,5-dichlorophenyl)hexanamide
CID 5055577
N-(5-acetamido-2-chlorophenyl)-7-aminoheptanamide;hydrochloride
CID 119707605
5-(2,5-dichloroanilino)-5-oxopentanoic acid
CID 3516353
6-amino-N-(2-bromo-4-chlorophenyl)hexanamide
CID 81263613
7-amino-N-[5-chloro-2-(dimethylamino)phenyl]heptanamide;dihydrochloride
CID 119858077
N-(2,5-dichlorophenyl)-3-hydroxypropanamide
CID 43558723
N-(2,5-dichlorophenyl)-6-(2,5-dioxopyrrolidin-1-yl)hexanamide
CID 17035036
3-[2-aminoethyl(methyl)amino]-N-(2,5-dichlorophenyl)propanamide
CID 55103947
3-(3-amino-2-methylpropyl)sulfanyl-N-(2,5-dichlorophenyl)propanamide
CID 66224538
N-(5-acetamido-2-chlorophenyl)-4-aminobutanamide;hydrochloride
CID 119280748
6-amino-N-(2-chloro-4-fluoro-5-methylphenyl)hexanamide
CID 112734750

Frequently Asked Questions

What is the IUPAC name of 6-amino-N-(2,5-dichlorophenyl)hexanamide?
The IUPAC name of 6-amino-N-(2,5-dichlorophenyl)hexanamide (CID 24694210) is 6-amino-N-(2,5-dichlorophenyl)hexanamide.
What is the SMILES notation for 6-amino-N-(2,5-dichlorophenyl)hexanamide?
The canonical SMILES for 6-amino-N-(2,5-dichlorophenyl)hexanamide is NCCCCCC(=O)Nc1cc(Cl)ccc1Cl.
What is the InChIKey of 6-amino-N-(2,5-dichlorophenyl)hexanamide?
The InChIKey is NYYUDXWCEIKFAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16Cl2N2O/c13-9-5-6-10(14)11(8-9)16-12(17)4-2-1-3-7-15/h5-6,8H,1-4,7,15H2,(H,16,17).
What are the key properties of 6-amino-N-(2,5-dichlorophenyl)hexanamide?
6-amino-N-(2,5-dichlorophenyl)hexanamide has a molecular weight of 275.18 g/mol, XLogP of 3.45, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-(2,5-dichlorophenyl)hexanamide is sourced from PubChem (CID 24694210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).