N'-[2-(2,4-dimethylphenoxy)acetyl]-4-(2-methoxyethoxy)benzohydrazide

C20H24N2O5 — CID 17353575

IUPACN'-[2-(2,4-dimethylphenoxy)acetyl]-4-(2-methoxyethoxy)benzohydrazide
SMILESCOCCOc1ccc(C(=O)NNC(=O)COc2ccc(C)cc2C)cc1
InChIInChI=1S/C20H24N2O5/c1-14-4-9-18(15(2)12-14)27-13-19(23)21-22-20(24)16-5-7-17(8-6-16)26-11-10-25-3/h4-9,12H,10-11,13H2,1-3H3,(H,21,23)(H,22,24)
InChIKeyKPGQEHXQCJNIHZ-UHFFFAOYSA-N
MW372.42 g/mol
LogP2.17
Rot. Bonds8

About N'-[2-(2,4-dimethylphenoxy)acetyl]-4-(2-methoxyethoxy)benzohydrazide

N'-[2-(2,4-dimethylphenoxy)acetyl]-4-(2-methoxyethoxy)benzohydrazide (PubChem CID 17353575) has the molecular formula C20H24N2O5 and a molecular weight of 372.42 g/mol. Its IUPAC name is N'-[2-(2,4-dimethylphenoxy)acetyl]-4-(2-methoxyethoxy)benzohydrazide.

Molecular Properties

Compound NameN'-[2-(2,4-dimethylphenoxy)acetyl]-4-(2-methoxyethoxy)benzohydrazide
PubChem CID17353575
Molecular FormulaC20H24N2O5
Molecular Weight372.42 g/mol
Exact Mass372.17
IUPAC NameN'-[2-(2,4-dimethylphenoxy)acetyl]-4-(2-methoxyethoxy)benzohydrazide
SMILESCOCCOc1ccc(C(=O)NNC(=O)COc2ccc(C)cc2C)cc1
InChIInChI=1S/C20H24N2O5/c1-14-4-9-18(15(2)12-14)27-13-19(23)21-22-20(24)16-5-7-17(8-6-16)26-11-10-25-3/h4-9,12H,10-11,13H2,1-3H3,(H,21,23)(H,22,24)
InChIKeyKPGQEHXQCJNIHZ-UHFFFAOYSA-N
XLogP2.17
TPSA85.89 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.42
LogP ≤ 52.17
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

4-tert-butyl-N'-[2-(2,4-dimethylphenoxy)acetyl]benzohydrazide
CID 4500599
N'-[2-(2,4-dimethylphenoxy)acetyl]benzohydrazide
CID 909269
N'-[2-(2,4-dimethylphenoxy)acetyl]-3,5-dimethylbenzohydrazide
CID 912611
N'-[2-(4-chloro-3,5-dimethylphenoxy)acetyl]-4-(2-methoxyethoxy)benzohydrazide
CID 17353571
N-(2,4-dimethylphenyl)-4-[2-[4-(2-methoxyethoxy)benzoyl]hydrazinyl]-4-oxobutanamide
CID 17353600
2-(4-tert-butylphenoxy)-N'-[2-(2,4-dimethylphenoxy)acetyl]acetohydrazide
CID 4945068
N'-[2-(2,5-dimethylphenoxy)acetyl]-4-ethoxybenzohydrazide
CID 26845933
N'-[2-(2-bromo-4-methylphenoxy)acetyl]-4-pentoxybenzohydrazide
CID 4935351
methyl 3-[[[2-(2,4-dimethylphenoxy)acetyl]amino]carbamoyl]benzoate
CID 17175383
N'-[2-(4-chloro-3-methylphenoxy)acetyl]-4-(2-methoxyethoxy)benzohydrazide
CID 17353570
N'-[2-(4-chloro-2-methylphenoxy)acetyl]-4-hexoxybenzohydrazide
CID 4930734
N'-[4-(2-methoxyethoxy)benzoyl]-3-methylbenzohydrazide
CID 17353579

Frequently Asked Questions

What is the IUPAC name of N'-[2-(2,4-dimethylphenoxy)acetyl]-4-(2-methoxyethoxy)benzohydrazide?
The IUPAC name of N'-[2-(2,4-dimethylphenoxy)acetyl]-4-(2-methoxyethoxy)benzohydrazide (CID 17353575) is N'-[2-(2,4-dimethylphenoxy)acetyl]-4-(2-methoxyethoxy)benzohydrazide.
What is the SMILES notation for N'-[2-(2,4-dimethylphenoxy)acetyl]-4-(2-methoxyethoxy)benzohydrazide?
The canonical SMILES for N'-[2-(2,4-dimethylphenoxy)acetyl]-4-(2-methoxyethoxy)benzohydrazide is COCCOc1ccc(C(=O)NNC(=O)COc2ccc(C)cc2C)cc1.
What is the InChIKey of N'-[2-(2,4-dimethylphenoxy)acetyl]-4-(2-methoxyethoxy)benzohydrazide?
The InChIKey is KPGQEHXQCJNIHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O5/c1-14-4-9-18(15(2)12-14)27-13-19(23)21-22-20(24)16-5-7-17(8-6-16)26-11-10-25-3/h4-9,12H,10-11,13H2,1-3H3,(H,21,23)(H,22,24).
What are the key properties of N'-[2-(2,4-dimethylphenoxy)acetyl]-4-(2-methoxyethoxy)benzohydrazide?
N'-[2-(2,4-dimethylphenoxy)acetyl]-4-(2-methoxyethoxy)benzohydrazide has a molecular weight of 372.42 g/mol, XLogP of 2.17, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-(2,4-dimethylphenoxy)acetyl]-4-(2-methoxyethoxy)benzohydrazide is sourced from PubChem (CID 17353575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).