N-[(E)-hexylideneamino]-4-hydroxybenzamide

C13H18N2O2 — CID 24749613

IUPACN-[(E)-hexylideneamino]-4-hydroxybenzamide
SMILESCCCCC/C=N/NC(=O)c1ccc(O)cc1
InChIInChI=1S/C13H18N2O2/c1-2-3-4-5-10-14-15-13(17)11-6-8-12(16)9-7-11/h6-10,16H,2-5H2,1H3,(H,15,17)/b14-10+
InChIKeyZVXHWFOAWXHDFF-GXDHUFHOSA-N
MW234.30 g/mol
LogP2.69
Rot. Bonds6

About N-[(E)-hexylideneamino]-4-hydroxybenzamide

N-[(E)-hexylideneamino]-4-hydroxybenzamide (PubChem CID 24749613) has the molecular formula C13H18N2O2 and a molecular weight of 234.30 g/mol. Its IUPAC name is N-[(E)-hexylideneamino]-4-hydroxybenzamide.

Molecular Properties

Compound NameN-[(E)-hexylideneamino]-4-hydroxybenzamide
PubChem CID24749613
Molecular FormulaC13H18N2O2
Molecular Weight234.30 g/mol
Exact Mass234.14
IUPAC NameN-[(E)-hexylideneamino]-4-hydroxybenzamide
SMILESCCCCC/C=N/NC(=O)c1ccc(O)cc1
InChIInChI=1S/C13H18N2O2/c1-2-3-4-5-10-14-15-13(17)11-6-8-12(16)9-7-11/h6-10,16H,2-5H2,1H3,(H,15,17)/b14-10+
InChIKeyZVXHWFOAWXHDFF-GXDHUFHOSA-N
XLogP2.69
TPSA61.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 52.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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-[(E)-hexylideneamino]-4-hydroxybenzamide 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-(heptylideneamino)-4-nitrobenzamide
CID 4526908
3-chloro-N-(nonylideneamino)benzamide
CID 3638264
4-bromo-N-[(Z)-butylideneamino]benzamide
CID 6262530
N-(dodecylideneamino)-3,5-dinitrobenzamide
CID 3258147
2-hydroxy-N-(pentylideneamino)benzamide
CID 3686688
4-chloro-N-[(E)-octylideneamino]-3-sulfamoylbenzamide
CID 10247913
N-[(E)-(4-ethylphenyl)methylideneamino]-4-hydroxybenzamide
CID 6906079
N-[(E)-(2-butoxyphenyl)methylideneamino]-4-hydroxybenzamide
CID 110338477
N-[(Z)-butylideneamino]-1-oxidopyridin-1-ium-4-carboxamide
CID 6146722
4-hydroxy-N-icosa-5,8,11,14-tetraenylbenzamide
CID 53394478
N-[(E)-[4-(dibutylamino)phenyl]methylideneamino]-4-hydroxybenzamide
CID 170647559
N-hentriacontanoyl-4-hydroxybenzamide
CID 139845214

Frequently Asked Questions

What is the IUPAC name of N-[(E)-hexylideneamino]-4-hydroxybenzamide?
The IUPAC name of N-[(E)-hexylideneamino]-4-hydroxybenzamide (CID 24749613) is N-[(E)-hexylideneamino]-4-hydroxybenzamide.
What is the SMILES notation for N-[(E)-hexylideneamino]-4-hydroxybenzamide?
The canonical SMILES for N-[(E)-hexylideneamino]-4-hydroxybenzamide is CCCCC/C=N/NC(=O)c1ccc(O)cc1.
What is the InChIKey of N-[(E)-hexylideneamino]-4-hydroxybenzamide?
The InChIKey is ZVXHWFOAWXHDFF-GXDHUFHOSA-N. The full InChI is InChI=1S/C13H18N2O2/c1-2-3-4-5-10-14-15-13(17)11-6-8-12(16)9-7-11/h6-10,16H,2-5H2,1H3,(H,15,17)/b14-10+.
What are the key properties of N-[(E)-hexylideneamino]-4-hydroxybenzamide?
N-[(E)-hexylideneamino]-4-hydroxybenzamide has a molecular weight of 234.30 g/mol, XLogP of 2.69, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(E)-hexylideneamino]-4-hydroxybenzamide is sourced from PubChem (CID 24749613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).