2-[2-[2-[2-(2-chlorophenoxy)acetyl]hydrazinyl]-2-oxoethoxy]benzamide

C17H16ClN3O5 — CID 9085660

IUPAC2-[2-[2-[2-(2-chlorophenoxy)acetyl]hydrazinyl]-2-oxoethoxy]benzamide
SMILESNC(=O)c1ccccc1OCC(=O)NNC(=O)COc1ccccc1Cl
InChIInChI=1S/C17H16ClN3O5/c18-12-6-2-4-8-14(12)26-10-16(23)21-20-15(22)9-25-13-7-3-1-5-11(13)17(19)24/h1-8H,9-10H2,(H2,19,24)(H,20,22)(H,21,23)
InChIKeyGIZDGDYZABEPNK-UHFFFAOYSA-N
MW377.78 g/mol
LogP1.04
Rot. Bonds7

About 2-[2-[2-[2-(2-chlorophenoxy)acetyl]hydrazinyl]-2-oxoethoxy]benzamide

2-[2-[2-[2-(2-chlorophenoxy)acetyl]hydrazinyl]-2-oxoethoxy]benzamide (PubChem CID 9085660) has the molecular formula C17H16ClN3O5 and a molecular weight of 377.78 g/mol. Its IUPAC name is 2-[2-[2-[2-(2-chlorophenoxy)acetyl]hydrazinyl]-2-oxoethoxy]benzamide.

Molecular Properties

Compound Name2-[2-[2-[2-(2-chlorophenoxy)acetyl]hydrazinyl]-2-oxoethoxy]benzamide
PubChem CID9085660
Molecular FormulaC17H16ClN3O5
Molecular Weight377.78 g/mol
Exact Mass377.08
IUPAC Name2-[2-[2-[2-(2-chlorophenoxy)acetyl]hydrazinyl]-2-oxoethoxy]benzamide
SMILESNC(=O)c1ccccc1OCC(=O)NNC(=O)COc1ccccc1Cl
InChIInChI=1S/C17H16ClN3O5/c18-12-6-2-4-8-14(12)26-10-16(23)21-20-15(22)9-25-13-7-3-1-5-11(13)17(19)24/h1-8H,9-10H2,(H2,19,24)(H,20,22)(H,21,23)
InChIKeyGIZDGDYZABEPNK-UHFFFAOYSA-N
XLogP1.04
TPSA119.75 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.78
LogP ≤ 51.04
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-[2-(2-chloroanilino)-2-oxoethoxy]benzamide
CID 3481891
2-[2-(methylamino)-2-oxoethoxy]benzamide
CID 2578374
N'-[2-(2-chlorophenoxy)acetyl]-2-prop-2-enoxybenzohydrazide
CID 4929148
2-(2-chlorophenoxy)-N-hydroxyacetamide
CID 95562486
2-(4-chlorophenoxy)-N'-[2-(2-chlorophenoxy)acetyl]acetohydrazide
CID 3372388
N-[[[2-(2-chlorophenoxy)acetyl]amino]carbamothioyl]-2-ethoxybenzamide
CID 4927105
N-[[[2-(2-chlorophenoxy)acetyl]amino]carbamothioyl]acetamide
CID 4922767
2-[2-[[(S)-(4-chlorophenyl)-phenylmethyl]amino]-2-oxoethoxy]benzamide
CID 8851691
N'-[2-(2-chlorophenoxy)acetyl]-2-(4-fluorophenoxy)acetohydrazide
CID 2561230
2-[2-(cyanoamino)-2-oxoethoxy]benzamide
CID 79194967
N-(2-acetylphenyl)-2-(2-chlorophenoxy)acetamide
CID 2707164
N-[[[2-(2-chlorophenoxy)acetyl]amino]carbamothioyl]-2-(2-methoxyphenoxy)acetamide
CID 4506696

Frequently Asked Questions

What is the IUPAC name of 2-[2-[2-[2-(2-chlorophenoxy)acetyl]hydrazinyl]-2-oxoethoxy]benzamide?
The IUPAC name of 2-[2-[2-[2-(2-chlorophenoxy)acetyl]hydrazinyl]-2-oxoethoxy]benzamide (CID 9085660) is 2-[2-[2-[2-(2-chlorophenoxy)acetyl]hydrazinyl]-2-oxoethoxy]benzamide.
What is the SMILES notation for 2-[2-[2-[2-(2-chlorophenoxy)acetyl]hydrazinyl]-2-oxoethoxy]benzamide?
The canonical SMILES for 2-[2-[2-[2-(2-chlorophenoxy)acetyl]hydrazinyl]-2-oxoethoxy]benzamide is NC(=O)c1ccccc1OCC(=O)NNC(=O)COc1ccccc1Cl.
What is the InChIKey of 2-[2-[2-[2-(2-chlorophenoxy)acetyl]hydrazinyl]-2-oxoethoxy]benzamide?
The InChIKey is GIZDGDYZABEPNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16ClN3O5/c18-12-6-2-4-8-14(12)26-10-16(23)21-20-15(22)9-25-13-7-3-1-5-11(13)17(19)24/h1-8H,9-10H2,(H2,19,24)(H,20,22)(H,21,23).
What are the key properties of 2-[2-[2-[2-(2-chlorophenoxy)acetyl]hydrazinyl]-2-oxoethoxy]benzamide?
2-[2-[2-[2-(2-chlorophenoxy)acetyl]hydrazinyl]-2-oxoethoxy]benzamide has a molecular weight of 377.78 g/mol, XLogP of 1.04, 7 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[2-[2-(2-chlorophenoxy)acetyl]hydrazinyl]-2-oxoethoxy]benzamide is sourced from PubChem (CID 9085660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).