N-[(Z)-(4-pentoxyphenyl)methylideneamino]dodecanamide

C24H40N2O2 — CID 6176857

IUPACN-[(Z)-(4-pentoxyphenyl)methylideneamino]dodecanamide
SMILESCCCCCCCCCCCC(=O)N/N=C\c1ccc(OCCCCC)cc1
InChIInChI=1S/C24H40N2O2/c1-3-5-7-8-9-10-11-12-13-15-24(27)26-25-21-22-16-18-23(19-17-22)28-20-14-6-4-2/h16-19,21H,3-15,20H2,1-2H3,(H,26,27)/b25-21-
InChIKeyQOAMUXYFLGAGJO-DAFNUICNSA-N
MW388.60 g/mol
LogP6.63
Rot. Bonds17

About N-[(Z)-(4-pentoxyphenyl)methylideneamino]dodecanamide

N-[(Z)-(4-pentoxyphenyl)methylideneamino]dodecanamide (PubChem CID 6176857) has the molecular formula C24H40N2O2 and a molecular weight of 388.60 g/mol. Its IUPAC name is N-[(Z)-(4-pentoxyphenyl)methylideneamino]dodecanamide.

Molecular Properties

Compound NameN-[(Z)-(4-pentoxyphenyl)methylideneamino]dodecanamide
PubChem CID6176857
Molecular FormulaC24H40N2O2
Molecular Weight388.60 g/mol
Exact Mass388.31
IUPAC NameN-[(Z)-(4-pentoxyphenyl)methylideneamino]dodecanamide
SMILESCCCCCCCCCCCC(=O)N/N=C\c1ccc(OCCCCC)cc1
InChIInChI=1S/C24H40N2O2/c1-3-5-7-8-9-10-11-12-13-15-24(27)26-25-21-22-16-18-23(19-17-22)28-20-14-6-4-2/h16-19,21H,3-15,20H2,1-2H3,(H,26,27)/b25-21-
InChIKeyQOAMUXYFLGAGJO-DAFNUICNSA-N
XLogP6.63
TPSA50.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds17
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500388.60
LogP ≤ 56.63
H-Bond Donors ≤ 51
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-[(Z)-(4-pentoxyphenyl)methylideneamino]dodecanamide 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)-(4-heptoxyphenyl)methylideneamino]octanamide
CID 6322467
N-[(4-butoxyphenyl)methylideneamino]dodecanamide
CID 3705573
N-[(Z)-(4-ethoxyphenyl)methylideneamino]octadecanamide
CID 98296453
N-[(E)-(4-prop-2-enoxyphenyl)methylideneamino]hexadecanamide
CID 51061289
N-[(4-methoxyphenyl)methylideneamino]nonanamide
CID 4175341
[(E)-(4-heptoxyphenyl)methylideneamino]urea
CID 14915218
N-[(Z)-(4-pentoxyphenyl)methylideneamino]acetamide
CID 9074224
2-(4-ethylphenoxy)-N-[(E)-(4-hexoxyphenyl)methylideneamino]acetamide
CID 19190683
N-[(4-phenylmethoxyphenyl)methylideneamino]hexadecanamide
CID 3861652
2-(4-chlorophenoxy)-N-[(E)-(4-hexoxyphenyl)methylideneamino]acetamide
CID 19190680
N-[(Z)-(4-phenylmethoxyphenyl)methylideneamino]dodecanamide
CID 6302563
[(E)-(4-pentoxyphenyl)methylideneamino]urea
CID 6909458

Frequently Asked Questions

What is the IUPAC name of N-[(Z)-(4-pentoxyphenyl)methylideneamino]dodecanamide?
The IUPAC name of N-[(Z)-(4-pentoxyphenyl)methylideneamino]dodecanamide (CID 6176857) is N-[(Z)-(4-pentoxyphenyl)methylideneamino]dodecanamide.
What is the SMILES notation for N-[(Z)-(4-pentoxyphenyl)methylideneamino]dodecanamide?
The canonical SMILES for N-[(Z)-(4-pentoxyphenyl)methylideneamino]dodecanamide is CCCCCCCCCCCC(=O)N/N=C\c1ccc(OCCCCC)cc1.
What is the InChIKey of N-[(Z)-(4-pentoxyphenyl)methylideneamino]dodecanamide?
The InChIKey is QOAMUXYFLGAGJO-DAFNUICNSA-N. The full InChI is InChI=1S/C24H40N2O2/c1-3-5-7-8-9-10-11-12-13-15-24(27)26-25-21-22-16-18-23(19-17-22)28-20-14-6-4-2/h16-19,21H,3-15,20H2,1-2H3,(H,26,27)/b25-21-.
What are the key properties of N-[(Z)-(4-pentoxyphenyl)methylideneamino]dodecanamide?
N-[(Z)-(4-pentoxyphenyl)methylideneamino]dodecanamide has a molecular weight of 388.60 g/mol, XLogP of 6.63, 17 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-(4-pentoxyphenyl)methylideneamino]dodecanamide is sourced from PubChem (CID 6176857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).