N'-[4-(2-ethoxyphenoxy)butanoyl]cyclohexanecarbohydrazide

C19H28N2O4 — CID 9327136

IUPACN'-[4-(2-ethoxyphenoxy)butanoyl]cyclohexanecarbohydrazide
SMILESCCOc1ccccc1OCCCC(=O)NNC(=O)C1CCCCC1
InChIInChI=1S/C19H28N2O4/c1-2-24-16-11-6-7-12-17(16)25-14-8-13-18(22)20-21-19(23)15-9-4-3-5-10-15/h6-7,11-12,15H,2-5,8-10,13-14H2,1H3,(H,20,22)(H,21,23)
InChIKeyOCPZKNFFDNHZGV-UHFFFAOYSA-N
MW348.44 g/mol
LogP2.97
Rot. Bonds8

About N'-[4-(2-ethoxyphenoxy)butanoyl]cyclohexanecarbohydrazide

N'-[4-(2-ethoxyphenoxy)butanoyl]cyclohexanecarbohydrazide (PubChem CID 9327136) has the molecular formula C19H28N2O4 and a molecular weight of 348.44 g/mol. Its IUPAC name is N'-[4-(2-ethoxyphenoxy)butanoyl]cyclohexanecarbohydrazide.

Molecular Properties

Compound NameN'-[4-(2-ethoxyphenoxy)butanoyl]cyclohexanecarbohydrazide
PubChem CID9327136
Molecular FormulaC19H28N2O4
Molecular Weight348.44 g/mol
Exact Mass348.20
IUPAC NameN'-[4-(2-ethoxyphenoxy)butanoyl]cyclohexanecarbohydrazide
SMILESCCOc1ccccc1OCCCC(=O)NNC(=O)C1CCCCC1
InChIInChI=1S/C19H28N2O4/c1-2-24-16-11-6-7-12-17(16)25-14-8-13-18(22)20-21-19(23)15-9-4-3-5-10-15/h6-7,11-12,15H,2-5,8-10,13-14H2,1H3,(H,20,22)(H,21,23)
InChIKeyOCPZKNFFDNHZGV-UHFFFAOYSA-N
XLogP2.97
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.44
LogP ≤ 52.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-cyclopentyl-4-(2-ethoxyphenoxy)butanamide
CID 78781833
1-cyclohexyl-3-(2-ethoxyphenoxy)propan-1-one
CID 39375404
4-(2-bromophenoxy)-N'-[2-(2-ethoxyphenoxy)acetyl]butanehydrazide
CID 55738830
N'-(cyclohexanecarbonyl)-3,4-diethoxybenzohydrazide
CID 912683
4-(2-ethoxyphenoxy)-N-ethylbutanamide
CID 78781225
N'-[2-(2-tert-butylphenoxy)acetyl]cyclohexanecarbohydrazide
CID 17050921
N'-[2-(2-phenylphenoxy)acetyl]cyclohexanecarbohydrazide
CID 3465565
N'-(2-phenoxyacetyl)cyclohexanecarbohydrazide
CID 695727
4-(2-ethoxyphenoxy)-N-(2-ethoxyphenyl)butanamide
CID 7935064
N'-[2-(2-methylphenoxy)acetyl]cyclobutanecarbohydrazide
CID 8696588
4-(2-ethoxyphenoxy)-N'-[2-(4-methylphenyl)sulfanylacetyl]butanehydrazide
CID 26311228
N-(8-azabicyclo[3.2.1]octan-3-yl)-4-(2-ethoxyphenoxy)butanamide
CID 119459385

Frequently Asked Questions

What is the IUPAC name of N'-[4-(2-ethoxyphenoxy)butanoyl]cyclohexanecarbohydrazide?
The IUPAC name of N'-[4-(2-ethoxyphenoxy)butanoyl]cyclohexanecarbohydrazide (CID 9327136) is N'-[4-(2-ethoxyphenoxy)butanoyl]cyclohexanecarbohydrazide.
What is the SMILES notation for N'-[4-(2-ethoxyphenoxy)butanoyl]cyclohexanecarbohydrazide?
The canonical SMILES for N'-[4-(2-ethoxyphenoxy)butanoyl]cyclohexanecarbohydrazide is CCOc1ccccc1OCCCC(=O)NNC(=O)C1CCCCC1.
What is the InChIKey of N'-[4-(2-ethoxyphenoxy)butanoyl]cyclohexanecarbohydrazide?
The InChIKey is OCPZKNFFDNHZGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N2O4/c1-2-24-16-11-6-7-12-17(16)25-14-8-13-18(22)20-21-19(23)15-9-4-3-5-10-15/h6-7,11-12,15H,2-5,8-10,13-14H2,1H3,(H,20,22)(H,21,23).
What are the key properties of N'-[4-(2-ethoxyphenoxy)butanoyl]cyclohexanecarbohydrazide?
N'-[4-(2-ethoxyphenoxy)butanoyl]cyclohexanecarbohydrazide has a molecular weight of 348.44 g/mol, XLogP of 2.97, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[4-(2-ethoxyphenoxy)butanoyl]cyclohexanecarbohydrazide is sourced from PubChem (CID 9327136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).