2-chloro-N'-[4-(2-methoxyethoxy)benzoyl]benzohydrazide

C17H17ClN2O4 — CID 17353590

IUPAC2-chloro-N'-[4-(2-methoxyethoxy)benzoyl]benzohydrazide
SMILESCOCCOc1ccc(C(=O)NNC(=O)c2ccccc2Cl)cc1
InChIInChI=1S/C17H17ClN2O4/c1-23-10-11-24-13-8-6-12(7-9-13)16(21)19-20-17(22)14-4-2-3-5-15(14)18/h2-9H,10-11H2,1H3,(H,19,21)(H,20,22)
InChIKeyIYDYTHORYRVJEF-UHFFFAOYSA-N
MW348.79 g/mol
LogP2.44
Rot. Bonds6

About 2-chloro-N'-[4-(2-methoxyethoxy)benzoyl]benzohydrazide

2-chloro-N'-[4-(2-methoxyethoxy)benzoyl]benzohydrazide (PubChem CID 17353590) has the molecular formula C17H17ClN2O4 and a molecular weight of 348.79 g/mol. Its IUPAC name is 2-chloro-N'-[4-(2-methoxyethoxy)benzoyl]benzohydrazide.

Molecular Properties

Compound Name2-chloro-N'-[4-(2-methoxyethoxy)benzoyl]benzohydrazide
PubChem CID17353590
Molecular FormulaC17H17ClN2O4
Molecular Weight348.79 g/mol
Exact Mass348.09
IUPAC Name2-chloro-N'-[4-(2-methoxyethoxy)benzoyl]benzohydrazide
SMILESCOCCOc1ccc(C(=O)NNC(=O)c2ccccc2Cl)cc1
InChIInChI=1S/C17H17ClN2O4/c1-23-10-11-24-13-8-6-12(7-9-13)16(21)19-20-17(22)14-4-2-3-5-15(14)18/h2-9H,10-11H2,1H3,(H,19,21)(H,20,22)
InChIKeyIYDYTHORYRVJEF-UHFFFAOYSA-N
XLogP2.44
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.79
LogP ≤ 52.44
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

2-chloro-N'-[4-(3-methylbutoxy)benzoyl]benzohydrazide
CID 4927887
2-chloro-N'-(4-methoxybenzoyl)benzohydrazide
CID 2170875
2-chloro-N'-[4-(2-phenylethoxy)benzoyl]benzohydrazide
CID 4956612
2-chloro-N'-[4-(2-methylpropoxy)benzoyl]benzohydrazide
CID 4930070
2-methoxy-N'-[4-(2-phenoxyethoxy)benzoyl]benzohydrazide
CID 4952919
2-chloro-N'-[4-[(4-chlorophenoxy)methyl]benzoyl]benzohydrazide
CID 24637056
N'-[4-(2-methoxyethoxy)benzoyl]-2-nitrobenzohydrazide
CID 17353581
N'-[4-(2-methoxyethoxy)benzoyl]-2-phenylmethoxybenzohydrazide
CID 17353669
3-bromo-N'-(2-chlorobenzoyl)-4-(2-methoxyethoxy)benzohydrazide
CID 17356627
methyl 4-[2-[2-(2-chlorobenzoyl)hydrazinyl]-2-oxoethoxy]benzoate
CID 1037884
2-chloro-N-[[[4-(3-methylbutoxy)benzoyl]amino]carbamothioyl]benzamide
CID 4928170
2-[[4-(2-methoxyethoxy)benzoyl]amino]benzamide
CID 15943277

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N'-[4-(2-methoxyethoxy)benzoyl]benzohydrazide?
The IUPAC name of 2-chloro-N'-[4-(2-methoxyethoxy)benzoyl]benzohydrazide (CID 17353590) is 2-chloro-N'-[4-(2-methoxyethoxy)benzoyl]benzohydrazide.
What is the SMILES notation for 2-chloro-N'-[4-(2-methoxyethoxy)benzoyl]benzohydrazide?
The canonical SMILES for 2-chloro-N'-[4-(2-methoxyethoxy)benzoyl]benzohydrazide is COCCOc1ccc(C(=O)NNC(=O)c2ccccc2Cl)cc1.
What is the InChIKey of 2-chloro-N'-[4-(2-methoxyethoxy)benzoyl]benzohydrazide?
The InChIKey is IYDYTHORYRVJEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17ClN2O4/c1-23-10-11-24-13-8-6-12(7-9-13)16(21)19-20-17(22)14-4-2-3-5-15(14)18/h2-9H,10-11H2,1H3,(H,19,21)(H,20,22).
What are the key properties of 2-chloro-N'-[4-(2-methoxyethoxy)benzoyl]benzohydrazide?
2-chloro-N'-[4-(2-methoxyethoxy)benzoyl]benzohydrazide has a molecular weight of 348.79 g/mol, XLogP of 2.44, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N'-[4-(2-methoxyethoxy)benzoyl]benzohydrazide is sourced from PubChem (CID 17353590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).