N,N'-bis[(Z)-(4-fluorophenyl)methylideneamino]decanediamide

C24H28F2N4O2 — CID 6277081

IUPACN,N'-bis[(Z)-(4-fluorophenyl)methylideneamino]decanediamide
SMILESO=C(CCCCCCCCC(=O)N/N=C\c1ccc(F)cc1)N/N=C\c1ccc(F)cc1
InChIInChI=1S/C24H28F2N4O2/c25-21-13-9-19(10-14-21)17-27-29-23(31)7-5-3-1-2-4-6-8-24(32)30-28-18-20-11-15-22(26)16-12-20/h9-18H,1-8H2,(H,29,31)(H,30,32)/b27-17-,28-18-
InChIKeyMBAYKYNITYAXIA-HJTNQMAYSA-N
MW442.51 g/mol
LogP4.69
Rot. Bonds13

About N,N'-bis[(Z)-(4-fluorophenyl)methylideneamino]decanediamide

N,N'-bis[(Z)-(4-fluorophenyl)methylideneamino]decanediamide (PubChem CID 6277081) has the molecular formula C24H28F2N4O2 and a molecular weight of 442.51 g/mol. Its IUPAC name is N,N'-bis[(Z)-(4-fluorophenyl)methylideneamino]decanediamide.

Molecular Properties

Compound NameN,N'-bis[(Z)-(4-fluorophenyl)methylideneamino]decanediamide
PubChem CID6277081
Molecular FormulaC24H28F2N4O2
Molecular Weight442.51 g/mol
Exact Mass442.22
IUPAC NameN,N'-bis[(Z)-(4-fluorophenyl)methylideneamino]decanediamide
SMILESO=C(CCCCCCCCC(=O)N/N=C\c1ccc(F)cc1)N/N=C\c1ccc(F)cc1
InChIInChI=1S/C24H28F2N4O2/c25-21-13-9-19(10-14-21)17-27-29-23(31)7-5-3-1-2-4-6-8-24(32)30-28-18-20-11-15-22(26)16-12-20/h9-18H,1-8H2,(H,29,31)(H,30,32)/b27-17-,28-18-
InChIKeyMBAYKYNITYAXIA-HJTNQMAYSA-N
XLogP4.69
TPSA82.92 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds13
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500442.51
LogP ≤ 54.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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,N'-bis[(Z)-(4-fluorophenyl)methylideneamino]decanediamide 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,N'-bis[(4-chlorophenyl)methylideneamino]nonanediamide
CID 3703961
N,N'-bis[(4-bromophenyl)methylideneamino]heptanediamide
CID 3539768
1-[(Z)-(4-fluorophenyl)methylideneamino]-3-[(4-fluorophenyl)methylideneamino]urea
CID 5383880
N-[(E)-(4-fluorophenyl)methylideneamino]-2-phenylacetamide
CID 6899001
N'-hydroxy-N-[(E)-(4-hydroxyphenyl)methylideneamino]octanediamide
CID 135883129
7-[(2E)-2-[(4-hydroxyphenyl)methylidene]hydrazinyl]-7-oxoheptanoic acid
CID 135777450
N-[(E)-(4-methylphenyl)methylideneamino]octanamide
CID 6042307
7-[(2E)-2-[(4-bromophenyl)methylidene]hydrazinyl]-7-oxoheptanoic acid
CID 23749398
N-[(E)-(4-iodophenyl)methylideneamino]-N'-[(Z)-(4-iodophenyl)methylideneamino]pentanediamide
CID 54610044
N-[(E)-[4-(dimethylamino)phenyl]methylideneamino]-N'-[(Z)-[4-(dimethylamino)phenyl]methylideneamino]hexanediamide
CID 92856210
N,N'-bis[(4-methylsulfanylphenyl)methylideneamino]pentanediamide
CID 4990030
4-fluoro-N-[(E)-(4-fluorophenyl)methylideneamino]benzamide
CID 5333155

Frequently Asked Questions

What is the IUPAC name of N,N'-bis[(Z)-(4-fluorophenyl)methylideneamino]decanediamide?
The IUPAC name of N,N'-bis[(Z)-(4-fluorophenyl)methylideneamino]decanediamide (CID 6277081) is N,N'-bis[(Z)-(4-fluorophenyl)methylideneamino]decanediamide.
What is the SMILES notation for N,N'-bis[(Z)-(4-fluorophenyl)methylideneamino]decanediamide?
The canonical SMILES for N,N'-bis[(Z)-(4-fluorophenyl)methylideneamino]decanediamide is O=C(CCCCCCCCC(=O)N/N=C\c1ccc(F)cc1)N/N=C\c1ccc(F)cc1.
What is the InChIKey of N,N'-bis[(Z)-(4-fluorophenyl)methylideneamino]decanediamide?
The InChIKey is MBAYKYNITYAXIA-HJTNQMAYSA-N. The full InChI is InChI=1S/C24H28F2N4O2/c25-21-13-9-19(10-14-21)17-27-29-23(31)7-5-3-1-2-4-6-8-24(32)30-28-18-20-11-15-22(26)16-12-20/h9-18H,1-8H2,(H,29,31)(H,30,32)/b27-17-,28-18-.
What are the key properties of N,N'-bis[(Z)-(4-fluorophenyl)methylideneamino]decanediamide?
N,N'-bis[(Z)-(4-fluorophenyl)methylideneamino]decanediamide has a molecular weight of 442.51 g/mol, XLogP of 4.69, 13 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N'-bis[(Z)-(4-fluorophenyl)methylideneamino]decanediamide is sourced from PubChem (CID 6277081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).