4-hexoxy-N'-(2-methylpropanoyl)benzohydrazide

C17H26N2O3 — CID 24677420

IUPAC4-hexoxy-N'-(2-methylpropanoyl)benzohydrazide
SMILESCCCCCCOc1ccc(C(=O)NNC(=O)C(C)C)cc1
InChIInChI=1S/C17H26N2O3/c1-4-5-6-7-12-22-15-10-8-14(9-11-15)17(21)19-18-16(20)13(2)3/h8-11,13H,4-7,12H2,1-3H3,(H,18,20)(H,19,21)
InChIKeyFJCPFESLUOXBGU-UHFFFAOYSA-N
MW306.41 g/mol
LogP3.06
Rot. Bonds8

About 4-hexoxy-N'-(2-methylpropanoyl)benzohydrazide

4-hexoxy-N'-(2-methylpropanoyl)benzohydrazide (PubChem CID 24677420) has the molecular formula C17H26N2O3 and a molecular weight of 306.41 g/mol. Its IUPAC name is 4-hexoxy-N'-(2-methylpropanoyl)benzohydrazide.

Molecular Properties

Compound Name4-hexoxy-N'-(2-methylpropanoyl)benzohydrazide
PubChem CID24677420
Molecular FormulaC17H26N2O3
Molecular Weight306.41 g/mol
Exact Mass306.19
IUPAC Name4-hexoxy-N'-(2-methylpropanoyl)benzohydrazide
SMILESCCCCCCOc1ccc(C(=O)NNC(=O)C(C)C)cc1
InChIInChI=1S/C17H26N2O3/c1-4-5-6-7-12-22-15-10-8-14(9-11-15)17(21)19-18-16(20)13(2)3/h8-11,13H,4-7,12H2,1-3H3,(H,18,20)(H,19,21)
InChIKeyFJCPFESLUOXBGU-UHFFFAOYSA-N
XLogP3.06
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.41
LogP ≤ 53.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 4-hexoxy-N'-(2-methylpropanoyl)benzohydrazide 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

4-(4-docosoxyphenyl)-N'-[4-(4-docosoxyphenyl)benzoyl]benzohydrazide
CID 102344080
N'-[4-(2-methylpropoxy)benzoyl]-4-pentoxybenzohydrazide
CID 4935435
4-hexoxy-N'-[4-(2-phenoxyethoxy)benzoyl]benzohydrazide
CID 4952932
N'-[2-(4-ethylphenoxy)propanoyl]-4-hexoxybenzohydrazide
CID 4953511
N'-heptanoyl-4-hexoxybenzohydrazide
CID 54789289
N'-[4-(2-ethoxyethoxy)benzoyl]-4-hexoxybenzohydrazide
CID 17112816
4-butoxy-N'-[4-(3-methylbutoxy)benzoyl]benzohydrazide
CID 4936465
[(4-octoxybenzoyl)amino]thiourea
CID 86177664
N-[4-[[(4-hexoxybenzoyl)amino]carbamoyl]phenyl]acetamide
CID 4933763
N'-(4-butoxybenzoyl)-4-ethoxybenzohydrazide
CID 7979581
4-hexoxy-N'-[2-(2-methylphenyl)acetyl]benzohydrazide
CID 26163669
4-hexoxy-N-[[(4-hexoxybenzoyl)amino]carbamothioyl]benzamide
CID 4934719

Frequently Asked Questions

What is the IUPAC name of 4-hexoxy-N'-(2-methylpropanoyl)benzohydrazide?
The IUPAC name of 4-hexoxy-N'-(2-methylpropanoyl)benzohydrazide (CID 24677420) is 4-hexoxy-N'-(2-methylpropanoyl)benzohydrazide.
What is the SMILES notation for 4-hexoxy-N'-(2-methylpropanoyl)benzohydrazide?
The canonical SMILES for 4-hexoxy-N'-(2-methylpropanoyl)benzohydrazide is CCCCCCOc1ccc(C(=O)NNC(=O)C(C)C)cc1.
What is the InChIKey of 4-hexoxy-N'-(2-methylpropanoyl)benzohydrazide?
The InChIKey is FJCPFESLUOXBGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O3/c1-4-5-6-7-12-22-15-10-8-14(9-11-15)17(21)19-18-16(20)13(2)3/h8-11,13H,4-7,12H2,1-3H3,(H,18,20)(H,19,21).
What are the key properties of 4-hexoxy-N'-(2-methylpropanoyl)benzohydrazide?
4-hexoxy-N'-(2-methylpropanoyl)benzohydrazide has a molecular weight of 306.41 g/mol, XLogP of 3.06, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hexoxy-N'-(2-methylpropanoyl)benzohydrazide is sourced from PubChem (CID 24677420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).