2-chloro-N-[2-[2-(4-chlorobenzoyl)hydrazinyl]-2-oxoethyl]benzamide

C16H13Cl2N3O3 — CID 35159240

IUPAC2-chloro-N-[2-[2-(4-chlorobenzoyl)hydrazinyl]-2-oxoethyl]benzamide
SMILESO=C(CNC(=O)c1ccccc1Cl)NNC(=O)c1ccc(Cl)cc1
InChIInChI=1S/C16H13Cl2N3O3/c17-11-7-5-10(6-8-11)15(23)21-20-14(22)9-19-16(24)12-3-1-2-4-13(12)18/h1-8H,9H2,(H,19,24)(H,20,22)(H,21,23)
InChIKeyNRQDCOJGYHPCLY-UHFFFAOYSA-N
MW366.20 g/mol
LogP2.18
Rot. Bonds4

About 2-chloro-N-[2-[2-(4-chlorobenzoyl)hydrazinyl]-2-oxoethyl]benzamide

2-chloro-N-[2-[2-(4-chlorobenzoyl)hydrazinyl]-2-oxoethyl]benzamide (PubChem CID 35159240) has the molecular formula C16H13Cl2N3O3 and a molecular weight of 366.20 g/mol. Its IUPAC name is 2-chloro-N-[2-[2-(4-chlorobenzoyl)hydrazinyl]-2-oxoethyl]benzamide.

Molecular Properties

Compound Name2-chloro-N-[2-[2-(4-chlorobenzoyl)hydrazinyl]-2-oxoethyl]benzamide
PubChem CID35159240
Molecular FormulaC16H13Cl2N3O3
Molecular Weight366.20 g/mol
Exact Mass365.03
IUPAC Name2-chloro-N-[2-[2-(4-chlorobenzoyl)hydrazinyl]-2-oxoethyl]benzamide
SMILESO=C(CNC(=O)c1ccccc1Cl)NNC(=O)c1ccc(Cl)cc1
InChIInChI=1S/C16H13Cl2N3O3/c17-11-7-5-10(6-8-11)15(23)21-20-14(22)9-19-16(24)12-3-1-2-4-13(12)18/h1-8H,9H2,(H,19,24)(H,20,22)(H,21,23)
InChIKeyNRQDCOJGYHPCLY-UHFFFAOYSA-N
XLogP2.18
TPSA87.30 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.20
LogP ≤ 52.18
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[2-(2-benzoylhydrazinyl)-2-oxoethyl]-4-chlorobenzamide
CID 9414874
N-[2-[2-(2-chlorobenzoyl)hydrazinyl]-2-oxoethyl]-2-fluorobenzamide
CID 35930552
N-[2-[2-(2-chlorobenzoyl)hydrazinyl]-2-oxoethyl]-3-fluorobenzamide
CID 35929184
[2-[2-(2-chlorobenzoyl)hydrazinyl]-2-oxoethyl] 4-chlorobenzoate
CID 9067593
N-[2-[2-(4-chlorobenzoyl)hydrazinyl]-2-oxoethyl]cyclopentanecarboxamide
CID 46450538
2-chloro-N-[2-[[(1R)-1-(4-chlorophenyl)ethyl]amino]-2-oxoethyl]benzamide
CID 9218518
2-chloro-N'-[4-[(4-chlorophenoxy)methyl]benzoyl]benzohydrazide
CID 24637056
2-chloro-N-[2-[2-[(4-chlorophenyl)methylidene]hydrazinyl]-2-oxoethyl]benzamide
CID 3436111
4-butoxy-N-[2-[2-(4-chlorobenzoyl)hydrazinyl]-2-oxoethyl]benzamide
CID 7971592
2-chloro-N-[2-oxo-2-[2-[2-(2-oxo-1-pyridinyl)acetyl]hydrazinyl]ethyl]benzamide
CID 9077775
1-N',5-N'-bis(4-chlorobenzoyl)pentanedihydrazide
CID 3361883
N-[2-[2-(2-chlorobenzoyl)hydrazinyl]-2-oxoethyl]-2-phenoxyacetamide
CID 7779481

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[2-[2-(4-chlorobenzoyl)hydrazinyl]-2-oxoethyl]benzamide?
The IUPAC name of 2-chloro-N-[2-[2-(4-chlorobenzoyl)hydrazinyl]-2-oxoethyl]benzamide (CID 35159240) is 2-chloro-N-[2-[2-(4-chlorobenzoyl)hydrazinyl]-2-oxoethyl]benzamide.
What is the SMILES notation for 2-chloro-N-[2-[2-(4-chlorobenzoyl)hydrazinyl]-2-oxoethyl]benzamide?
The canonical SMILES for 2-chloro-N-[2-[2-(4-chlorobenzoyl)hydrazinyl]-2-oxoethyl]benzamide is O=C(CNC(=O)c1ccccc1Cl)NNC(=O)c1ccc(Cl)cc1.
What is the InChIKey of 2-chloro-N-[2-[2-(4-chlorobenzoyl)hydrazinyl]-2-oxoethyl]benzamide?
The InChIKey is NRQDCOJGYHPCLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13Cl2N3O3/c17-11-7-5-10(6-8-11)15(23)21-20-14(22)9-19-16(24)12-3-1-2-4-13(12)18/h1-8H,9H2,(H,19,24)(H,20,22)(H,21,23).
What are the key properties of 2-chloro-N-[2-[2-(4-chlorobenzoyl)hydrazinyl]-2-oxoethyl]benzamide?
2-chloro-N-[2-[2-(4-chlorobenzoyl)hydrazinyl]-2-oxoethyl]benzamide has a molecular weight of 366.20 g/mol, XLogP of 2.18, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-[2-[2-(4-chlorobenzoyl)hydrazinyl]-2-oxoethyl]benzamide is sourced from PubChem (CID 35159240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).