N-[1-(2-hydroxyphenyl)propylideneamino]pentanamide

C14H20N2O2 — CID 4060923

IUPACN-[1-(2-hydroxyphenyl)propylideneamino]pentanamide
SMILESCCCCC(=O)NN=C(CC)c1ccccc1O
InChIInChI=1S/C14H20N2O2/c1-3-5-10-14(18)16-15-12(4-2)11-8-6-7-9-13(11)17/h6-9,17H,3-5,10H2,1-2H3,(H,16,18)
InChIKeyLMBHILNUGJFVQH-UHFFFAOYSA-N
MW248.33 g/mol
LogP2.81
Rot. Bonds6

About N-[1-(2-hydroxyphenyl)propylideneamino]pentanamide

N-[1-(2-hydroxyphenyl)propylideneamino]pentanamide (PubChem CID 4060923) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is N-[1-(2-hydroxyphenyl)propylideneamino]pentanamide.

Molecular Properties

Compound NameN-[1-(2-hydroxyphenyl)propylideneamino]pentanamide
PubChem CID4060923
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC NameN-[1-(2-hydroxyphenyl)propylideneamino]pentanamide
SMILESCCCCC(=O)NN=C(CC)c1ccccc1O
InChIInChI=1S/C14H20N2O2/c1-3-5-10-14(18)16-15-12(4-2)11-8-6-7-9-13(11)17/h6-9,17H,3-5,10H2,1-2H3,(H,16,18)
InChIKeyLMBHILNUGJFVQH-UHFFFAOYSA-N
XLogP2.81
TPSA61.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 52.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N-[1-(2-hydroxyphenyl)propylideneamino]pentanamide 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)-1-(2-hydroxyphenyl)propylideneamino]dodecanamide
CID 135533779
N,N'-bis[1-(2-hydroxyphenyl)propylideneamino]hexanediamide
CID 3340797
N-(1-phenylpropylideneamino)pentanamide
CID 4996868
N-[1-(2-hydroxyphenyl)ethylideneamino]decanamide
CID 3656120
N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]octanamide
CID 135458893
4-(2,4-dichlorophenoxy)-N-[1-(2-hydroxyphenyl)propylideneamino]butanamide
CID 4163359
N-[(Z)-1-(4-hydroxyphenyl)propylideneamino]hexanamide
CID 136716001
N-[(E)-1-(4-hydroxyphenyl)propylideneamino]dodecanamide
CID 135704395
N-(1-phenylpentylideneamino)octanamide
CID 4676930
N-[(E)-1-(4-methoxyphenyl)propylideneamino]pentanamide
CID 6379049
N,N'-bis[(E)-1-(4-hydroxyphenyl)propylideneamino]hexanediamide
CID 135721513
N-[(E)-1-(2-hydroxyphenyl)propylideneamino]-4-methylbenzamide
CID 135716964

Frequently Asked Questions

What is the IUPAC name of N-[1-(2-hydroxyphenyl)propylideneamino]pentanamide?
The IUPAC name of N-[1-(2-hydroxyphenyl)propylideneamino]pentanamide (CID 4060923) is N-[1-(2-hydroxyphenyl)propylideneamino]pentanamide.
What is the SMILES notation for N-[1-(2-hydroxyphenyl)propylideneamino]pentanamide?
The canonical SMILES for N-[1-(2-hydroxyphenyl)propylideneamino]pentanamide is CCCCC(=O)NN=C(CC)c1ccccc1O.
What is the InChIKey of N-[1-(2-hydroxyphenyl)propylideneamino]pentanamide?
The InChIKey is LMBHILNUGJFVQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2/c1-3-5-10-14(18)16-15-12(4-2)11-8-6-7-9-13(11)17/h6-9,17H,3-5,10H2,1-2H3,(H,16,18).
What are the key properties of N-[1-(2-hydroxyphenyl)propylideneamino]pentanamide?
N-[1-(2-hydroxyphenyl)propylideneamino]pentanamide has a molecular weight of 248.33 g/mol, XLogP of 2.81, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-hydroxyphenyl)propylideneamino]pentanamide is sourced from PubChem (CID 4060923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).