5-chloro-2-(2-phenoxyethoxy)benzohydrazide

C15H15ClN2O3 — CID 54795635

IUPAC5-chloro-2-(2-phenoxyethoxy)benzohydrazide
SMILESNNC(=O)c1cc(Cl)ccc1OCCOc1ccccc1
InChIInChI=1S/C15H15ClN2O3/c16-11-6-7-14(13(10-11)15(19)18-17)21-9-8-20-12-4-2-1-3-5-12/h1-7,10H,8-9,17H2,(H,18,19)
InChIKeyVLINWDMVBYVHLU-UHFFFAOYSA-N
MW306.75 g/mol
LogP2.40
Rot. Bonds6

About 5-chloro-2-(2-phenoxyethoxy)benzohydrazide

5-chloro-2-(2-phenoxyethoxy)benzohydrazide (PubChem CID 54795635) has the molecular formula C15H15ClN2O3 and a molecular weight of 306.75 g/mol. Its IUPAC name is 5-chloro-2-(2-phenoxyethoxy)benzohydrazide.

Molecular Properties

Compound Name5-chloro-2-(2-phenoxyethoxy)benzohydrazide
PubChem CID54795635
Molecular FormulaC15H15ClN2O3
Molecular Weight306.75 g/mol
Exact Mass306.08
IUPAC Name5-chloro-2-(2-phenoxyethoxy)benzohydrazide
SMILESNNC(=O)c1cc(Cl)ccc1OCCOc1ccccc1
InChIInChI=1S/C15H15ClN2O3/c16-11-6-7-14(13(10-11)15(19)18-17)21-9-8-20-12-4-2-1-3-5-12/h1-7,10H,8-9,17H2,(H,18,19)
InChIKeyVLINWDMVBYVHLU-UHFFFAOYSA-N
XLogP2.40
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.75
LogP ≤ 52.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-butoxy-5-chlorobenzohydrazide
CID 54795706
5-chloro-2-[2-(3-chlorophenoxy)ethoxy]benzoic acid
CID 60651656
N-(2,4-dichlorophenyl)-2-(2-phenoxyethoxy)benzamide
CID 4954259
5-chloro-2-(2-cyclohexylethoxy)benzohydrazide
CID 54795643
N-(5-chloro-2-methylphenyl)-2-(2-phenoxyethoxy)benzamide
CID 4954394
2,4-dichloro-N-[2-(2-phenoxyethoxy)phenyl]benzamide
CID 17130832
1-(5-chloro-2-methoxyphenyl)-3-phenoxypropan-1-one
CID 62790945
5-chloro-2-methoxy-N'-(2-phenoxyacetyl)benzohydrazide
CID 2634898
2-phenoxyethyl 2-[(2,4-dichlorobenzoyl)amino]acetate
CID 7843771
N-(3-aminopropyl)-5-chloro-2-(2-methoxyethoxy)benzamide;hydrochloride
CID 119405795
5-chloro-2-[2-(2,5-dichlorophenoxy)ethoxy]benzoic acid
CID 20988301
5-chloro-2-propoxybenzoic acid;tungsten
CID 58176462

Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-(2-phenoxyethoxy)benzohydrazide?
The IUPAC name of 5-chloro-2-(2-phenoxyethoxy)benzohydrazide (CID 54795635) is 5-chloro-2-(2-phenoxyethoxy)benzohydrazide.
What is the SMILES notation for 5-chloro-2-(2-phenoxyethoxy)benzohydrazide?
The canonical SMILES for 5-chloro-2-(2-phenoxyethoxy)benzohydrazide is NNC(=O)c1cc(Cl)ccc1OCCOc1ccccc1.
What is the InChIKey of 5-chloro-2-(2-phenoxyethoxy)benzohydrazide?
The InChIKey is VLINWDMVBYVHLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15ClN2O3/c16-11-6-7-14(13(10-11)15(19)18-17)21-9-8-20-12-4-2-1-3-5-12/h1-7,10H,8-9,17H2,(H,18,19).
What are the key properties of 5-chloro-2-(2-phenoxyethoxy)benzohydrazide?
5-chloro-2-(2-phenoxyethoxy)benzohydrazide has a molecular weight of 306.75 g/mol, XLogP of 2.40, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-(2-phenoxyethoxy)benzohydrazide is sourced from PubChem (CID 54795635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).