N-[(Z)-(2,5-dimethoxyphenyl)methylideneamino]cyclohexanecarboxamide

C16H22N2O3 — CID 6113811

IUPACN-[(Z)-(2,5-dimethoxyphenyl)methylideneamino]cyclohexanecarboxamide
SMILESCOc1ccc(OC)c(/C=N\NC(=O)C2CCCCC2)c1
InChIInChI=1S/C16H22N2O3/c1-20-14-8-9-15(21-2)13(10-14)11-17-18-16(19)12-6-4-3-5-7-12/h8-12H,3-7H2,1-2H3,(H,18,19)/b17-11-
InChIKeyBXEZEKMVQBTCGB-BOPFTXTBSA-N
MW290.36 g/mol
LogP2.73
Rot. Bonds5

About N-[(Z)-(2,5-dimethoxyphenyl)methylideneamino]cyclohexanecarboxamide

N-[(Z)-(2,5-dimethoxyphenyl)methylideneamino]cyclohexanecarboxamide (PubChem CID 6113811) has the molecular formula C16H22N2O3 and a molecular weight of 290.36 g/mol. Its IUPAC name is N-[(Z)-(2,5-dimethoxyphenyl)methylideneamino]cyclohexanecarboxamide.

Molecular Properties

Compound NameN-[(Z)-(2,5-dimethoxyphenyl)methylideneamino]cyclohexanecarboxamide
PubChem CID6113811
Molecular FormulaC16H22N2O3
Molecular Weight290.36 g/mol
Exact Mass290.16
IUPAC NameN-[(Z)-(2,5-dimethoxyphenyl)methylideneamino]cyclohexanecarboxamide
SMILESCOc1ccc(OC)c(/C=N\NC(=O)C2CCCCC2)c1
InChIInChI=1S/C16H22N2O3/c1-20-14-8-9-15(21-2)13(10-14)11-17-18-16(19)12-6-4-3-5-7-12/h8-12H,3-7H2,1-2H3,(H,18,19)/b17-11-
InChIKeyBXEZEKMVQBTCGB-BOPFTXTBSA-N
XLogP2.73
TPSA59.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.36
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze N-[(Z)-(2,5-dimethoxyphenyl)methylideneamino]cyclohexanecarboxamide 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

1-benzoyl-N-[(Z)-(2,5-dimethoxyphenyl)methylideneamino]piperidine-4-carboxamide
CID 126012287
N-[(Z)-(2,5-dimethoxyphenyl)methylideneamino]-1-(3-methoxybenzoyl)piperidine-4-carboxamide
CID 126013819
1-[(4-chlorophenyl)methyl]-N-[(2,5-dimethoxyphenyl)methylideneamino]piperidine-4-carboxamide
CID 1275389
methyl N-[(2,5-dimethoxyphenyl)methylideneamino]carbamate
CID 5087461
1-[(4-bromophenyl)methyl]-N-[(2,5-dimethoxyphenyl)methylideneamino]piperidine-4-carboxamide
CID 1273710
N-[(E)-(2-hydroxy-3-methoxyphenyl)methylideneamino]cyclohexanecarboxamide
CID 135532188
2-(azepan-1-yl)-N-[(E)-(2,5-dimethoxyphenyl)methylideneamino]acetamide
CID 5338398
trans-(1S,2S)-N-[(Z)-(2,5-dimethoxyphenyl)methylideneamino]-2-phenylcyclopropane-1-carboxamide
CID 6588159
N'-[(Z)-(2,5-dimethoxyphenyl)methylideneamino]-N-methyloxamide
CID 126140196
[4-[(Z)-(cyclohexanecarbonylhydrazinylidene)methyl]-2-methoxyphenyl] acetate
CID 5419986
N-[(2-hydroxy-3-methoxyphenyl)methylideneamino]cyclobutanecarboxamide
CID 923591
N-[(2,4-diethoxyphenyl)methylideneamino]cyclopentanecarboxamide
CID 24818496

Frequently Asked Questions

What is the IUPAC name of N-[(Z)-(2,5-dimethoxyphenyl)methylideneamino]cyclohexanecarboxamide?
The IUPAC name of N-[(Z)-(2,5-dimethoxyphenyl)methylideneamino]cyclohexanecarboxamide (CID 6113811) is N-[(Z)-(2,5-dimethoxyphenyl)methylideneamino]cyclohexanecarboxamide.
What is the SMILES notation for N-[(Z)-(2,5-dimethoxyphenyl)methylideneamino]cyclohexanecarboxamide?
The canonical SMILES for N-[(Z)-(2,5-dimethoxyphenyl)methylideneamino]cyclohexanecarboxamide is COc1ccc(OC)c(/C=N\NC(=O)C2CCCCC2)c1.
What is the InChIKey of N-[(Z)-(2,5-dimethoxyphenyl)methylideneamino]cyclohexanecarboxamide?
The InChIKey is BXEZEKMVQBTCGB-BOPFTXTBSA-N. The full InChI is InChI=1S/C16H22N2O3/c1-20-14-8-9-15(21-2)13(10-14)11-17-18-16(19)12-6-4-3-5-7-12/h8-12H,3-7H2,1-2H3,(H,18,19)/b17-11-.
What are the key properties of N-[(Z)-(2,5-dimethoxyphenyl)methylideneamino]cyclohexanecarboxamide?
N-[(Z)-(2,5-dimethoxyphenyl)methylideneamino]cyclohexanecarboxamide has a molecular weight of 290.36 g/mol, XLogP of 2.73, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-(2,5-dimethoxyphenyl)methylideneamino]cyclohexanecarboxamide is sourced from PubChem (CID 6113811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).