N-[1-(2,4-dihydroxyphenyl)ethylideneamino]decanamide

C18H28N2O3 — CID 4124156

IUPACN-[1-(2,4-dihydroxyphenyl)ethylideneamino]decanamide
SMILESCCCCCCCCCC(=O)NN=C(C)c1ccc(O)cc1O
InChIInChI=1S/C18H28N2O3/c1-3-4-5-6-7-8-9-10-18(23)20-19-14(2)16-12-11-15(21)13-17(16)22/h11-13,21-22H,3-10H2,1-2H3,(H,20,23)
InChIKeyKEZREFUGLRXKSF-UHFFFAOYSA-N
MW320.43 g/mol
LogP4.08
Rot. Bonds10

About N-[1-(2,4-dihydroxyphenyl)ethylideneamino]decanamide

N-[1-(2,4-dihydroxyphenyl)ethylideneamino]decanamide (PubChem CID 4124156) has the molecular formula C18H28N2O3 and a molecular weight of 320.43 g/mol. Its IUPAC name is N-[1-(2,4-dihydroxyphenyl)ethylideneamino]decanamide.

Molecular Properties

Compound NameN-[1-(2,4-dihydroxyphenyl)ethylideneamino]decanamide
PubChem CID4124156
Molecular FormulaC18H28N2O3
Molecular Weight320.43 g/mol
Exact Mass320.21
IUPAC NameN-[1-(2,4-dihydroxyphenyl)ethylideneamino]decanamide
SMILESCCCCCCCCCC(=O)NN=C(C)c1ccc(O)cc1O
InChIInChI=1S/C18H28N2O3/c1-3-4-5-6-7-8-9-10-18(23)20-19-14(2)16-12-11-15(21)13-17(16)22/h11-13,21-22H,3-10H2,1-2H3,(H,20,23)
InChIKeyKEZREFUGLRXKSF-UHFFFAOYSA-N
XLogP4.08
TPSA81.92 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.43
LogP ≤ 54.08
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hzone_phenol_A(479)', 'substructure': 'N/A'}, {'alert_name': 'hzone_phenol_B(215)', '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'}

Analyze N-[1-(2,4-dihydroxyphenyl)ethylideneamino]decanamide 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-[(Z)-1-(2,4-dihydroxyphenyl)ethylideneamino]nonanamide
CID 136717836
N-[1-(2-hydroxyphenyl)ethylideneamino]decanamide
CID 3656120
N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]octanamide
CID 135458893
N-[1-(2,4-dimethylphenyl)ethylideneamino]decanamide
CID 3291865
N-[(E)-1-(3-hydroxyphenyl)ethylideneamino]decanamide
CID 19685450
N'-dodecanoyl-2,4-dihydroxybenzohydrazide
CID 18983784
N-[1-(2,4-dihydroxyphenyl)ethylideneamino]-2-(3-hydroxyphenyl)acetamide
CID 143033643
N-[(E)-1-(4-hydroxyphenyl)ethylideneamino]pentanamide
CID 135799262
N-[(E)-1-(1-hydroxynaphthalen-2-yl)ethylideneamino]hexanamide
CID 135601125
N'-[1-(2,4-dihydroxyphenyl)ethylideneamino]-N-(2,5-dimethylphenyl)butanediamide
CID 3677655
N,N'-bis[(Z)-1-(4-hydroxyphenyl)ethylideneamino]nonanediamide
CID 136878224
N-[1-(3,4-dimethylphenyl)ethylideneamino]undecanamide
CID 3644436

Frequently Asked Questions

What is the IUPAC name of N-[1-(2,4-dihydroxyphenyl)ethylideneamino]decanamide?
The IUPAC name of N-[1-(2,4-dihydroxyphenyl)ethylideneamino]decanamide (CID 4124156) is N-[1-(2,4-dihydroxyphenyl)ethylideneamino]decanamide.
What is the SMILES notation for N-[1-(2,4-dihydroxyphenyl)ethylideneamino]decanamide?
The canonical SMILES for N-[1-(2,4-dihydroxyphenyl)ethylideneamino]decanamide is CCCCCCCCCC(=O)NN=C(C)c1ccc(O)cc1O.
What is the InChIKey of N-[1-(2,4-dihydroxyphenyl)ethylideneamino]decanamide?
The InChIKey is KEZREFUGLRXKSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2O3/c1-3-4-5-6-7-8-9-10-18(23)20-19-14(2)16-12-11-15(21)13-17(16)22/h11-13,21-22H,3-10H2,1-2H3,(H,20,23).
What are the key properties of N-[1-(2,4-dihydroxyphenyl)ethylideneamino]decanamide?
N-[1-(2,4-dihydroxyphenyl)ethylideneamino]decanamide has a molecular weight of 320.43 g/mol, XLogP of 4.08, 10 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2,4-dihydroxyphenyl)ethylideneamino]decanamide is sourced from PubChem (CID 4124156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).