N'-[2-(2-ethoxyphenoxy)acetyl]-3,4-dimethylbenzohydrazide

C19H22N2O4 — CID 2102668

IUPACN'-[2-(2-ethoxyphenoxy)acetyl]-3,4-dimethylbenzohydrazide
SMILESCCOc1ccccc1OCC(=O)NNC(=O)c1ccc(C)c(C)c1
InChIInChI=1S/C19H22N2O4/c1-4-24-16-7-5-6-8-17(16)25-12-18(22)20-21-19(23)15-10-9-13(2)14(3)11-15/h5-11H,4,12H2,1-3H3,(H,20,22)(H,21,23)
InChIKeyDTDJZDYKLRZEPR-UHFFFAOYSA-N
MW342.40 g/mol
LogP2.54
Rot. Bonds6

About N'-[2-(2-ethoxyphenoxy)acetyl]-3,4-dimethylbenzohydrazide

N'-[2-(2-ethoxyphenoxy)acetyl]-3,4-dimethylbenzohydrazide (PubChem CID 2102668) has the molecular formula C19H22N2O4 and a molecular weight of 342.40 g/mol. Its IUPAC name is N'-[2-(2-ethoxyphenoxy)acetyl]-3,4-dimethylbenzohydrazide.

Molecular Properties

Compound NameN'-[2-(2-ethoxyphenoxy)acetyl]-3,4-dimethylbenzohydrazide
PubChem CID2102668
Molecular FormulaC19H22N2O4
Molecular Weight342.40 g/mol
Exact Mass342.16
IUPAC NameN'-[2-(2-ethoxyphenoxy)acetyl]-3,4-dimethylbenzohydrazide
SMILESCCOc1ccccc1OCC(=O)NNC(=O)c1ccc(C)c(C)c1
InChIInChI=1S/C19H22N2O4/c1-4-24-16-7-5-6-8-17(16)25-12-18(22)20-21-19(23)15-10-9-13(2)14(3)11-15/h5-11H,4,12H2,1-3H3,(H,20,22)(H,21,23)
InChIKeyDTDJZDYKLRZEPR-UHFFFAOYSA-N
XLogP2.54
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.40
LogP ≤ 52.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N'-[2-(2-ethoxyphenoxy)acetyl]-4-methylbenzohydrazide
CID 7918380
N'-[2-(2-ethoxyphenoxy)acetyl]-3,4-dipropoxybenzohydrazide
CID 55358632
3,4-dichloro-N'-[2-(2-ethoxyphenoxy)acetyl]benzohydrazide
CID 2091621
N'-[2-(2-chlorophenoxy)acetyl]-3,4-diethoxybenzohydrazide
CID 7601114
N-[2-[[2-(2-methoxyphenoxy)acetyl]amino]ethyl]-3,4-dimethylbenzamide
CID 108542880
4-ethoxy-3-methoxy-N'-[2-(2-methylphenyl)acetyl]benzohydrazide
CID 30860668
6-chloro-N'-[2-(2-ethoxyphenoxy)acetyl]pyridine-3-carbohydrazide
CID 18287311
5-bromo-N'-[2-(2-ethoxyphenoxy)acetyl]pyridine-3-carbohydrazide
CID 18159243
N'-[2-(2-ethoxyphenoxy)acetyl]-2-methoxybenzohydrazide
CID 18159247
4-chloro-N'-[2-(2-ethoxyphenoxy)acetyl]-3-nitrobenzohydrazide
CID 19168127
N'-[2-(2-methoxyphenoxy)acetyl]naphthalene-2-carbohydrazide
CID 1047417
3-bromo-N'-[2-(2-methylphenoxy)acetyl]benzohydrazide
CID 7719967

Frequently Asked Questions

What is the IUPAC name of N'-[2-(2-ethoxyphenoxy)acetyl]-3,4-dimethylbenzohydrazide?
The IUPAC name of N'-[2-(2-ethoxyphenoxy)acetyl]-3,4-dimethylbenzohydrazide (CID 2102668) is N'-[2-(2-ethoxyphenoxy)acetyl]-3,4-dimethylbenzohydrazide.
What is the SMILES notation for N'-[2-(2-ethoxyphenoxy)acetyl]-3,4-dimethylbenzohydrazide?
The canonical SMILES for N'-[2-(2-ethoxyphenoxy)acetyl]-3,4-dimethylbenzohydrazide is CCOc1ccccc1OCC(=O)NNC(=O)c1ccc(C)c(C)c1.
What is the InChIKey of N'-[2-(2-ethoxyphenoxy)acetyl]-3,4-dimethylbenzohydrazide?
The InChIKey is DTDJZDYKLRZEPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O4/c1-4-24-16-7-5-6-8-17(16)25-12-18(22)20-21-19(23)15-10-9-13(2)14(3)11-15/h5-11H,4,12H2,1-3H3,(H,20,22)(H,21,23).
What are the key properties of N'-[2-(2-ethoxyphenoxy)acetyl]-3,4-dimethylbenzohydrazide?
N'-[2-(2-ethoxyphenoxy)acetyl]-3,4-dimethylbenzohydrazide has a molecular weight of 342.40 g/mol, XLogP of 2.54, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-(2-ethoxyphenoxy)acetyl]-3,4-dimethylbenzohydrazide is sourced from PubChem (CID 2102668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).