2-(2-ethoxyethoxy)-N'-(4-hexoxybenzoyl)benzohydrazide

C24H32N2O5 — CID 17122913

IUPAC2-(2-ethoxyethoxy)-N'-(4-hexoxybenzoyl)benzohydrazide
SMILESCCCCCCOc1ccc(C(=O)NNC(=O)c2ccccc2OCCOCC)cc1
InChIInChI=1S/C24H32N2O5/c1-3-5-6-9-16-30-20-14-12-19(13-15-20)23(27)25-26-24(28)21-10-7-8-11-22(21)31-18-17-29-4-2/h7-8,10-15H,3-6,9,16-18H2,1-2H3,(H,25,27)(H,26,28)
InChIKeySDHHSUGKNOUNNC-UHFFFAOYSA-N
MW428.53 g/mol
LogP4.14
Rot. Bonds13

About 2-(2-ethoxyethoxy)-N'-(4-hexoxybenzoyl)benzohydrazide

2-(2-ethoxyethoxy)-N'-(4-hexoxybenzoyl)benzohydrazide (PubChem CID 17122913) has the molecular formula C24H32N2O5 and a molecular weight of 428.53 g/mol. Its IUPAC name is 2-(2-ethoxyethoxy)-N'-(4-hexoxybenzoyl)benzohydrazide.

Molecular Properties

Compound Name2-(2-ethoxyethoxy)-N'-(4-hexoxybenzoyl)benzohydrazide
PubChem CID17122913
Molecular FormulaC24H32N2O5
Molecular Weight428.53 g/mol
Exact Mass428.23
IUPAC Name2-(2-ethoxyethoxy)-N'-(4-hexoxybenzoyl)benzohydrazide
SMILESCCCCCCOc1ccc(C(=O)NNC(=O)c2ccccc2OCCOCC)cc1
InChIInChI=1S/C24H32N2O5/c1-3-5-6-9-16-30-20-14-12-19(13-15-20)23(27)25-26-24(28)21-10-7-8-11-22(21)31-18-17-29-4-2/h7-8,10-15H,3-6,9,16-18H2,1-2H3,(H,25,27)(H,26,28)
InChIKeySDHHSUGKNOUNNC-UHFFFAOYSA-N
XLogP4.14
TPSA85.89 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds13
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500428.53
LogP ≤ 54.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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'-[4-(2-ethoxyethoxy)benzoyl]-4-hexoxybenzohydrazide
CID 17112816
2-methoxy-N'-(4-octoxybenzoyl)benzohydrazide
CID 139600143
2-(2-ethoxyethoxy)-N'-(4-prop-2-enoxybenzoyl)benzohydrazide
CID 17122908
N'-(4-hexoxybenzoyl)-2-hydroxybenzohydrazide
CID 5223816
4-hexoxy-N'-[4-(2-phenoxyethoxy)benzoyl]benzohydrazide
CID 4952932
N'-(4-butoxybenzoyl)-2-phenylmethoxybenzohydrazide
CID 4938160
2-bromo-N'-(4-heptoxybenzoyl)benzohydrazide
CID 4950819
N'-(4-hexadecoxybenzoyl)naphthalene-1-carbohydrazide
CID 162371332
2-fluoro-N'-(4-pentoxybenzoyl)benzohydrazide
CID 9402566
propyl 4-[2-[2-[2-(2-ethoxyethoxy)benzoyl]hydrazinyl]-2-oxoethoxy]benzoate
CID 17122909
N-[4-[[[2-(2-ethoxyethoxy)benzoyl]amino]carbamoyl]phenyl]propanamide
CID 17122839
2-hexoxy-N'-[2-(4-methylphenoxy)acetyl]benzohydrazide
CID 4942278

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethoxyethoxy)-N'-(4-hexoxybenzoyl)benzohydrazide?
The IUPAC name of 2-(2-ethoxyethoxy)-N'-(4-hexoxybenzoyl)benzohydrazide (CID 17122913) is 2-(2-ethoxyethoxy)-N'-(4-hexoxybenzoyl)benzohydrazide.
What is the SMILES notation for 2-(2-ethoxyethoxy)-N'-(4-hexoxybenzoyl)benzohydrazide?
The canonical SMILES for 2-(2-ethoxyethoxy)-N'-(4-hexoxybenzoyl)benzohydrazide is CCCCCCOc1ccc(C(=O)NNC(=O)c2ccccc2OCCOCC)cc1.
What is the InChIKey of 2-(2-ethoxyethoxy)-N'-(4-hexoxybenzoyl)benzohydrazide?
The InChIKey is SDHHSUGKNOUNNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H32N2O5/c1-3-5-6-9-16-30-20-14-12-19(13-15-20)23(27)25-26-24(28)21-10-7-8-11-22(21)31-18-17-29-4-2/h7-8,10-15H,3-6,9,16-18H2,1-2H3,(H,25,27)(H,26,28).
What are the key properties of 2-(2-ethoxyethoxy)-N'-(4-hexoxybenzoyl)benzohydrazide?
2-(2-ethoxyethoxy)-N'-(4-hexoxybenzoyl)benzohydrazide has a molecular weight of 428.53 g/mol, XLogP of 4.14, 13 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethoxyethoxy)-N'-(4-hexoxybenzoyl)benzohydrazide is sourced from PubChem (CID 17122913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).