N-[(2,6-dichlorophenyl)methylideneamino]nonanamide

C16H22Cl2N2O — CID 3711942

IUPACN-[(2,6-dichlorophenyl)methylideneamino]nonanamide
SMILESCCCCCCCCC(=O)NN=Cc1c(Cl)cccc1Cl
InChIInChI=1S/C16H22Cl2N2O/c1-2-3-4-5-6-7-11-16(21)20-19-12-13-14(17)9-8-10-15(13)18/h8-10,12H,2-7,11H2,1H3,(H,20,21)
InChIKeyKFJTZVIXYIQRFK-UHFFFAOYSA-N
MW329.27 g/mol
LogP5.19
Rot. Bonds9

About N-[(2,6-dichlorophenyl)methylideneamino]nonanamide

N-[(2,6-dichlorophenyl)methylideneamino]nonanamide (PubChem CID 3711942) has the molecular formula C16H22Cl2N2O and a molecular weight of 329.27 g/mol. Its IUPAC name is N-[(2,6-dichlorophenyl)methylideneamino]nonanamide.

Molecular Properties

Compound NameN-[(2,6-dichlorophenyl)methylideneamino]nonanamide
PubChem CID3711942
Molecular FormulaC16H22Cl2N2O
Molecular Weight329.27 g/mol
Exact Mass328.11
IUPAC NameN-[(2,6-dichlorophenyl)methylideneamino]nonanamide
SMILESCCCCCCCCC(=O)NN=Cc1c(Cl)cccc1Cl
InChIInChI=1S/C16H22Cl2N2O/c1-2-3-4-5-6-7-11-16(21)20-19-12-13-14(17)9-8-10-15(13)18/h8-10,12H,2-7,11H2,1H3,(H,20,21)
InChIKeyKFJTZVIXYIQRFK-UHFFFAOYSA-N
XLogP5.19
TPSA41.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500329.27
LogP ≤ 55.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N-[(2,6-dichlorophenyl)methylideneamino]nonanamide 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-[(E)-(3-chlorophenyl)methylideneamino]octadecanamide
CID 45054960
N-[(3-chlorophenyl)methylideneamino]hexadecanamide
CID 75087758
N-[(E)-benzylideneamino]heptanamide
CID 6083821
N-(benzylideneamino)decanamide
CID 3430585
N-[(4-chlorophenyl)methylideneamino]hexanamide
CID 4197078
N-[2-[(2Z)-2-[(2-chlorophenyl)methylidene]hydrazinyl]-2-oxoethyl]dodecanamide
CID 6056379
N-[(Z)-(2-hydroxynaphthalen-1-yl)methylideneamino]undecanamide
CID 135738478
N-[(2-hydroxynaphthalen-1-yl)methylideneamino]dodecanamide
CID 5068789
N-[(2-hydroxyphenyl)methylideneamino]undecanamide
CID 5053269
N-[(2-hydroxyphenyl)methylideneamino]octanamide
CID 3393777
[4-[(Z)-(hexadecanoylhydrazinylidene)methyl]phenyl] 2-chlorobenzoate
CID 98298432
N-[(2-methylphenyl)methylideneamino]undecanamide
CID 4136077

Frequently Asked Questions

What is the IUPAC name of N-[(2,6-dichlorophenyl)methylideneamino]nonanamide?
The IUPAC name of N-[(2,6-dichlorophenyl)methylideneamino]nonanamide (CID 3711942) is N-[(2,6-dichlorophenyl)methylideneamino]nonanamide.
What is the SMILES notation for N-[(2,6-dichlorophenyl)methylideneamino]nonanamide?
The canonical SMILES for N-[(2,6-dichlorophenyl)methylideneamino]nonanamide is CCCCCCCCC(=O)NN=Cc1c(Cl)cccc1Cl.
What is the InChIKey of N-[(2,6-dichlorophenyl)methylideneamino]nonanamide?
The InChIKey is KFJTZVIXYIQRFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22Cl2N2O/c1-2-3-4-5-6-7-11-16(21)20-19-12-13-14(17)9-8-10-15(13)18/h8-10,12H,2-7,11H2,1H3,(H,20,21).
What are the key properties of N-[(2,6-dichlorophenyl)methylideneamino]nonanamide?
N-[(2,6-dichlorophenyl)methylideneamino]nonanamide has a molecular weight of 329.27 g/mol, XLogP of 5.19, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,6-dichlorophenyl)methylideneamino]nonanamide is sourced from PubChem (CID 3711942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).