2-chloro-5-hydroxy-N',N'-dimethylbenzohydrazide

C9H11ClN2O2 — CID 106502069

IUPAC2-chloro-5-hydroxy-N',N'-dimethylbenzohydrazide
SMILESCN(C)NC(=O)c1cc(O)ccc1Cl
InChIInChI=1S/C9H11ClN2O2/c1-12(2)11-9(14)7-5-6(13)3-4-8(7)10/h3-5,13H,1-2H3,(H,11,14)
InChIKeyXKJIZWLEJBZQAG-UHFFFAOYSA-N
MW214.65 g/mol
LogP1.25
Rot. Bonds2

About 2-chloro-5-hydroxy-N',N'-dimethylbenzohydrazide

2-chloro-5-hydroxy-N',N'-dimethylbenzohydrazide (PubChem CID 106502069) has the molecular formula C9H11ClN2O2 and a molecular weight of 214.65 g/mol. Its IUPAC name is 2-chloro-5-hydroxy-N',N'-dimethylbenzohydrazide.

Molecular Properties

Compound Name2-chloro-5-hydroxy-N',N'-dimethylbenzohydrazide
PubChem CID106502069
Molecular FormulaC9H11ClN2O2
Molecular Weight214.65 g/mol
Exact Mass214.05
IUPAC Name2-chloro-5-hydroxy-N',N'-dimethylbenzohydrazide
SMILESCN(C)NC(=O)c1cc(O)ccc1Cl
InChIInChI=1S/C9H11ClN2O2/c1-12(2)11-9(14)7-5-6(13)3-4-8(7)10/h3-5,13H,1-2H3,(H,11,14)
InChIKeyXKJIZWLEJBZQAG-UHFFFAOYSA-N
XLogP1.25
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.65
LogP ≤ 51.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-amino-5-hydroxy-N',N'-dimethylbenzohydrazide
CID 107075849
5-hydroxy-N',N'-dimethyl-2-nitrobenzohydrazide
CID 107076386
2-chloro-N-[2-(dimethylsulfamoyl)ethyl]-5-hydroxybenzamide
CID 106339733
2-chloro-N',N'-dimethyl-5-morpholin-4-ylsulfonylbenzohydrazide
CID 9163691
2-chloro-N-[[1-(dimethylamino)cyclopentyl]methyl]-5-hydroxybenzamide
CID 106502082
2-chloro-N-[2-(ethylamino)-2-oxoethyl]-5-hydroxy-N-methylbenzamide
CID 106501594
2-chloro-N-(1-cyano-2-methylpropyl)-5-hydroxybenzamide
CID 106501016
2-chloro-5-hydroxy-N-(2,4,5-trichlorophenyl)benzamide
CID 106501235
2-chloro-5-hydroxy-N-methyl-N-(2-methylprop-2-enyl)benzamide
CID 106502176
2-chloro-N-(2,5-dichloro-4-methylphenyl)-5-hydroxybenzamide
CID 106502134
2-chloro-5-hydroxy-N-[2-(propan-2-ylamino)ethyl]benzamide
CID 106502576
N-(1-bromopropan-2-yl)-2-chloro-5-hydroxybenzamide
CID 106503155

Frequently Asked Questions

What is the IUPAC name of 2-chloro-5-hydroxy-N',N'-dimethylbenzohydrazide?
The IUPAC name of 2-chloro-5-hydroxy-N',N'-dimethylbenzohydrazide (CID 106502069) is 2-chloro-5-hydroxy-N',N'-dimethylbenzohydrazide.
What is the SMILES notation for 2-chloro-5-hydroxy-N',N'-dimethylbenzohydrazide?
The canonical SMILES for 2-chloro-5-hydroxy-N',N'-dimethylbenzohydrazide is CN(C)NC(=O)c1cc(O)ccc1Cl.
What is the InChIKey of 2-chloro-5-hydroxy-N',N'-dimethylbenzohydrazide?
The InChIKey is XKJIZWLEJBZQAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11ClN2O2/c1-12(2)11-9(14)7-5-6(13)3-4-8(7)10/h3-5,13H,1-2H3,(H,11,14).
What are the key properties of 2-chloro-5-hydroxy-N',N'-dimethylbenzohydrazide?
2-chloro-5-hydroxy-N',N'-dimethylbenzohydrazide has a molecular weight of 214.65 g/mol, XLogP of 1.25, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-5-hydroxy-N',N'-dimethylbenzohydrazide is sourced from PubChem (CID 106502069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).