N-[(2-hydroxyphenyl)methylideneamino]undecanamide

C18H28N2O2 — CID 5053269

IUPACN-[(2-hydroxyphenyl)methylideneamino]undecanamide
SMILESCCCCCCCCCCC(=O)NN=Cc1ccccc1O
InChIInChI=1S/C18H28N2O2/c1-2-3-4-5-6-7-8-9-14-18(22)20-19-15-16-12-10-11-13-17(16)21/h10-13,15,21H,2-9,14H2,1H3,(H,20,22)
InChIKeyHDWLHTVRKOLSOC-UHFFFAOYSA-N
MW304.43 g/mol
LogP4.37
Rot. Bonds11

About N-[(2-hydroxyphenyl)methylideneamino]undecanamide

N-[(2-hydroxyphenyl)methylideneamino]undecanamide (PubChem CID 5053269) has the molecular formula C18H28N2O2 and a molecular weight of 304.43 g/mol. Its IUPAC name is N-[(2-hydroxyphenyl)methylideneamino]undecanamide.

Molecular Properties

Compound NameN-[(2-hydroxyphenyl)methylideneamino]undecanamide
PubChem CID5053269
Molecular FormulaC18H28N2O2
Molecular Weight304.43 g/mol
Exact Mass304.22
IUPAC NameN-[(2-hydroxyphenyl)methylideneamino]undecanamide
SMILESCCCCCCCCCCC(=O)NN=Cc1ccccc1O
InChIInChI=1S/C18H28N2O2/c1-2-3-4-5-6-7-8-9-14-18(22)20-19-15-16-12-10-11-13-17(16)21/h10-13,15,21H,2-9,14H2,1H3,(H,20,22)
InChIKeyHDWLHTVRKOLSOC-UHFFFAOYSA-N
XLogP4.37
TPSA61.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds11
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.43
LogP ≤ 54.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hzone_phenol_A(479)', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-[(2-hydroxyphenyl)methylideneamino]octanamide
CID 3393777
N-[(E)-(2-hydroxyphenyl)methylideneamino]pentanamide
CID 135509646
N,N'-bis[(E)-(2-hydroxyphenyl)methylideneamino]decanediamide
CID 135555032
N-[2-[(2Z)-2-[(2-hydroxyphenyl)methylidene]hydrazinyl]-2-oxoethyl]tetradecanamide
CID 136719377
N-[(2-methylphenyl)methylideneamino]undecanamide
CID 4136077
N-[(Z)-(2-hydroxyphenyl)methylideneamino]undec-10-enamide
CID 136802207
N-[[2-(trifluoromethyl)phenyl]methylideneamino]decanamide
CID 5075472
N-[(E)-[2-(trifluoromethyl)phenyl]methylideneamino]octadecanamide
CID 45054433
N-[(E)-benzylideneamino]heptanamide
CID 6083821
N-(benzylideneamino)decanamide
CID 3430585
N-[(5-bromo-2-hydroxyphenyl)methylideneamino]hexanamide
CID 3623985
N-[(2-hydroxy-5-nitrosophenyl)methylideneamino]hexanamide
CID 175194656

Frequently Asked Questions

What is the IUPAC name of N-[(2-hydroxyphenyl)methylideneamino]undecanamide?
The IUPAC name of N-[(2-hydroxyphenyl)methylideneamino]undecanamide (CID 5053269) is N-[(2-hydroxyphenyl)methylideneamino]undecanamide.
What is the SMILES notation for N-[(2-hydroxyphenyl)methylideneamino]undecanamide?
The canonical SMILES for N-[(2-hydroxyphenyl)methylideneamino]undecanamide is CCCCCCCCCCC(=O)NN=Cc1ccccc1O.
What is the InChIKey of N-[(2-hydroxyphenyl)methylideneamino]undecanamide?
The InChIKey is HDWLHTVRKOLSOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2O2/c1-2-3-4-5-6-7-8-9-14-18(22)20-19-15-16-12-10-11-13-17(16)21/h10-13,15,21H,2-9,14H2,1H3,(H,20,22).
What are the key properties of N-[(2-hydroxyphenyl)methylideneamino]undecanamide?
N-[(2-hydroxyphenyl)methylideneamino]undecanamide has a molecular weight of 304.43 g/mol, XLogP of 4.37, 11 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-hydroxyphenyl)methylideneamino]undecanamide is sourced from PubChem (CID 5053269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).