4-chloro-N-(2-hydrazinyl-2-oxoethyl)benzamide

C9H10ClN3O2 — CID 792434

IUPAC4-chloro-N-(2-hydrazinyl-2-oxoethyl)benzamide
SMILESNNC(=O)CNC(=O)c1ccc(Cl)cc1
InChIInChI=1S/C9H10ClN3O2/c10-7-3-1-6(2-4-7)9(15)12-5-8(14)13-11/h1-4H,5,11H2,(H,12,15)(H,13,14)
InChIKeyGYHIZQVCUKJWSI-UHFFFAOYSA-N
MW227.65 g/mol
LogP0.06
Rot. Bonds3

About 4-chloro-N-(2-hydrazinyl-2-oxoethyl)benzamide

4-chloro-N-(2-hydrazinyl-2-oxoethyl)benzamide (PubChem CID 792434) has the molecular formula C9H10ClN3O2 and a molecular weight of 227.65 g/mol. Its IUPAC name is 4-chloro-N-(2-hydrazinyl-2-oxoethyl)benzamide.

Molecular Properties

Compound Name4-chloro-N-(2-hydrazinyl-2-oxoethyl)benzamide
PubChem CID792434
Molecular FormulaC9H10ClN3O2
Molecular Weight227.65 g/mol
Exact Mass227.05
IUPAC Name4-chloro-N-(2-hydrazinyl-2-oxoethyl)benzamide
SMILESNNC(=O)CNC(=O)c1ccc(Cl)cc1
InChIInChI=1S/C9H10ClN3O2/c10-7-3-1-6(2-4-7)9(15)12-5-8(14)13-11/h1-4H,5,11H2,(H,12,15)(H,13,14)
InChIKeyGYHIZQVCUKJWSI-UHFFFAOYSA-N
XLogP0.06
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.65
LogP ≤ 50.06
H-Bond Donors ≤ 53
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

N-(2-hydrazinyl-2-oxoethyl)-4-methylbenzamide
CID 17349905
4-chloro-N-[2-(methoxyamino)-2-oxoethyl]benzamide
CID 60701327
2-[(4-chlorobenzoyl)amino]acetyl chloride
CID 14545092
N-[2-(2-benzoylhydrazinyl)-2-oxoethyl]-4-chlorobenzamide
CID 9414874
aluminum tris(2-[(4-chlorobenzoyl)amino]acetate)
CID 70603247
N-[2-(butan-2-ylamino)-2-oxoethyl]-4-chlorobenzamide
CID 60634738
4-ethoxy-N-(2-hydrazinyl-2-oxoethyl)benzamide
CID 17349908
4-chloro-N-[2-[[(2R)-2-hydroxypropyl]amino]-2-oxoethyl]benzamide
CID 83031853
4-chloro-N-[2-(4-methylanilino)-2-oxoethyl]benzamide
CID 2989490
4-chloro-N-[2-(2,6-dimethylanilino)-2-oxoethyl]benzamide
CID 2679820
(2R)-2-[[2-[(4-chlorobenzoyl)amino]acetyl]amino]-3-hydroxypropanoic acid
CID 80749551
2-chloroethyl 2-[(4-chlorobenzoyl)amino]acetate
CID 7038818

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-(2-hydrazinyl-2-oxoethyl)benzamide?
The IUPAC name of 4-chloro-N-(2-hydrazinyl-2-oxoethyl)benzamide (CID 792434) is 4-chloro-N-(2-hydrazinyl-2-oxoethyl)benzamide.
What is the SMILES notation for 4-chloro-N-(2-hydrazinyl-2-oxoethyl)benzamide?
The canonical SMILES for 4-chloro-N-(2-hydrazinyl-2-oxoethyl)benzamide is NNC(=O)CNC(=O)c1ccc(Cl)cc1.
What is the InChIKey of 4-chloro-N-(2-hydrazinyl-2-oxoethyl)benzamide?
The InChIKey is GYHIZQVCUKJWSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10ClN3O2/c10-7-3-1-6(2-4-7)9(15)12-5-8(14)13-11/h1-4H,5,11H2,(H,12,15)(H,13,14).
What are the key properties of 4-chloro-N-(2-hydrazinyl-2-oxoethyl)benzamide?
4-chloro-N-(2-hydrazinyl-2-oxoethyl)benzamide has a molecular weight of 227.65 g/mol, XLogP of 0.06, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-(2-hydrazinyl-2-oxoethyl)benzamide is sourced from PubChem (CID 792434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).