2-hydrazinyl-2-phenylacetyl chloride

C8H9ClN2O — CID 55280591

IUPAC2-hydrazinyl-2-phenylacetyl chloride
SMILESNNC(C(=O)Cl)c1ccccc1
InChIInChI=1S/C8H9ClN2O/c9-8(12)7(11-10)6-4-2-1-3-5-6/h1-5,7,11H,10H2
InChIKeyMRUOVZVDMYJIKK-UHFFFAOYSA-N
MW184.63 g/mol
LogP0.96
Rot. Bonds3

About 2-hydrazinyl-2-phenylacetyl chloride

2-hydrazinyl-2-phenylacetyl chloride (PubChem CID 55280591) has the molecular formula C8H9ClN2O and a molecular weight of 184.63 g/mol. Its IUPAC name is 2-hydrazinyl-2-phenylacetyl chloride.

Molecular Properties

Compound Name2-hydrazinyl-2-phenylacetyl chloride
PubChem CID55280591
Molecular FormulaC8H9ClN2O
Molecular Weight184.63 g/mol
Exact Mass184.04
IUPAC Name2-hydrazinyl-2-phenylacetyl chloride
SMILESNNC(C(=O)Cl)c1ccccc1
InChIInChI=1S/C8H9ClN2O/c9-8(12)7(11-10)6-4-2-1-3-5-6/h1-5,7,11H,10H2
InChIKeyMRUOVZVDMYJIKK-UHFFFAOYSA-N
XLogP0.96
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.63
LogP ≤ 50.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2-hydrazinyl-2-phenylacetyl chloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2S)-2-[[(1R)-2-chloro-2-oxo-1-phenylethyl]amino]-2-phenylacetyl chloride
CID 124679301
2-(chloroamino)-2-phenylacetamide
CID 89152727
2-phenylpropanedihydrazide
CID 11424318
2-hydrazinyl-2-phenyl-1-piperazin-1-ylethanone
CID 82510408
2-(3-chlorophenyl)-2-hydrazinylacetic acid
CID 82125968
N-(2-hydrazinyl-2-oxo-1-phenylethyl)benzamide
CID 4534244
2-amino-2-phenylacetyl chloride;hydron;chloride
CID 51056098
methyl 3-chloro-3-oxo-2-phenylpropanoate
CID 12726479
2-(3-acetamidoanilino)-2-phenylacetyl chloride
CID 142788297
(2S)-2-[(2-aminoacetyl)amino]-2-phenylacetic acid;hydrobromide
CID 70535754
[chloro(phenyl)methyl]hydrazine
CID 67761420
2-(4-fluorophenyl)-2-hydrazinylacetic acid
CID 82125359

Frequently Asked Questions

What is the IUPAC name of 2-hydrazinyl-2-phenylacetyl chloride?
The IUPAC name of 2-hydrazinyl-2-phenylacetyl chloride (CID 55280591) is 2-hydrazinyl-2-phenylacetyl chloride.
What is the SMILES notation for 2-hydrazinyl-2-phenylacetyl chloride?
The canonical SMILES for 2-hydrazinyl-2-phenylacetyl chloride is NNC(C(=O)Cl)c1ccccc1.
What is the InChIKey of 2-hydrazinyl-2-phenylacetyl chloride?
The InChIKey is MRUOVZVDMYJIKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9ClN2O/c9-8(12)7(11-10)6-4-2-1-3-5-6/h1-5,7,11H,10H2.
What are the key properties of 2-hydrazinyl-2-phenylacetyl chloride?
2-hydrazinyl-2-phenylacetyl chloride has a molecular weight of 184.63 g/mol, XLogP of 0.96, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydrazinyl-2-phenylacetyl chloride is sourced from PubChem (CID 55280591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).