2-[(2-chlorophenoxy)methyl]benzohydrazide

C14H13ClN2O2 — CID 63576691

IUPAC2-[(2-chlorophenoxy)methyl]benzohydrazide
SMILESNNC(=O)c1ccccc1COc1ccccc1Cl
InChIInChI=1S/C14H13ClN2O2/c15-12-7-3-4-8-13(12)19-9-10-5-1-2-6-11(10)14(18)17-16/h1-8H,9,16H2,(H,17,18)
InChIKeyKMEYAVVUVRHUKB-UHFFFAOYSA-N
MW276.72 g/mol
LogP2.52
Rot. Bonds4

About 2-[(2-chlorophenoxy)methyl]benzohydrazide

2-[(2-chlorophenoxy)methyl]benzohydrazide (PubChem CID 63576691) has the molecular formula C14H13ClN2O2 and a molecular weight of 276.72 g/mol. Its IUPAC name is 2-[(2-chlorophenoxy)methyl]benzohydrazide.

Molecular Properties

Compound Name2-[(2-chlorophenoxy)methyl]benzohydrazide
PubChem CID63576691
Molecular FormulaC14H13ClN2O2
Molecular Weight276.72 g/mol
Exact Mass276.07
IUPAC Name2-[(2-chlorophenoxy)methyl]benzohydrazide
SMILESNNC(=O)c1ccccc1COc1ccccc1Cl
InChIInChI=1S/C14H13ClN2O2/c15-12-7-3-4-8-13(12)19-9-10-5-1-2-6-11(10)14(18)17-16/h1-8H,9,16H2,(H,17,18)
InChIKeyKMEYAVVUVRHUKB-UHFFFAOYSA-N
XLogP2.52
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.72
LogP ≤ 52.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', '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-[[2-(hydroxymethyl)phenoxy]methyl]benzohydrazide
CID 63680399
2-[(2-methoxyphenoxy)methyl]benzohydrazide
CID 63576535
2-[2-[(2-chlorophenoxy)methyl]phenyl]acetic acid
CID 22366404
5-[(2-chlorophenoxy)methyl]-1,2-oxazole-3-carbohydrazide
CID 63577021
2-[(2,4-dimethylphenoxy)methyl]benzohydrazide
CID 63576319
4-[(2-chlorophenoxy)methyl]-5-methylfuran-2-carbohydrazide
CID 55212421
2-[(4-ethoxyphenoxy)methyl]benzohydrazide
CID 63577001
5-[(2-chlorophenoxy)methyl]thiophene-2-carbohydrazide
CID 55212226
2-[(2-chlorophenoxy)methyl]-5-hydroxybenzoic acid
CID 117221100
2-[(2-chlorophenyl)methoxy]-N'-(2-fluorobenzoyl)benzohydrazide
CID 26901785
2-[(4-cyanophenoxy)methyl]benzohydrazide
CID 63574454
2-[(5-cyano-2-methylphenoxy)methyl]benzohydrazide
CID 107661586

Frequently Asked Questions

What is the IUPAC name of 2-[(2-chlorophenoxy)methyl]benzohydrazide?
The IUPAC name of 2-[(2-chlorophenoxy)methyl]benzohydrazide (CID 63576691) is 2-[(2-chlorophenoxy)methyl]benzohydrazide.
What is the SMILES notation for 2-[(2-chlorophenoxy)methyl]benzohydrazide?
The canonical SMILES for 2-[(2-chlorophenoxy)methyl]benzohydrazide is NNC(=O)c1ccccc1COc1ccccc1Cl.
What is the InChIKey of 2-[(2-chlorophenoxy)methyl]benzohydrazide?
The InChIKey is KMEYAVVUVRHUKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13ClN2O2/c15-12-7-3-4-8-13(12)19-9-10-5-1-2-6-11(10)14(18)17-16/h1-8H,9,16H2,(H,17,18).
What are the key properties of 2-[(2-chlorophenoxy)methyl]benzohydrazide?
2-[(2-chlorophenoxy)methyl]benzohydrazide has a molecular weight of 276.72 g/mol, XLogP of 2.52, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-chlorophenoxy)methyl]benzohydrazide is sourced from PubChem (CID 63576691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).