N'-[2-(4-nitrophenoxy)acetyl]-2-phenylacetohydrazide

C16H15N3O5 — CID 922307

IUPACN'-[2-(4-nitrophenoxy)acetyl]-2-phenylacetohydrazide
SMILESO=C(COc1ccc([N+](=O)[O-])cc1)NNC(=O)Cc1ccccc1
InChIInChI=1S/C16H15N3O5/c20-15(10-12-4-2-1-3-5-12)17-18-16(21)11-24-14-8-6-13(7-9-14)19(22)23/h1-9H,10-11H2,(H,17,20)(H,18,21)
InChIKeyLARZERYSEOVRBZ-UHFFFAOYSA-N
MW329.31 g/mol
LogP1.36
Rot. Bonds6

About N'-[2-(4-nitrophenoxy)acetyl]-2-phenylacetohydrazide

N'-[2-(4-nitrophenoxy)acetyl]-2-phenylacetohydrazide (PubChem CID 922307) has the molecular formula C16H15N3O5 and a molecular weight of 329.31 g/mol. Its IUPAC name is N'-[2-(4-nitrophenoxy)acetyl]-2-phenylacetohydrazide.

Molecular Properties

Compound NameN'-[2-(4-nitrophenoxy)acetyl]-2-phenylacetohydrazide
PubChem CID922307
Molecular FormulaC16H15N3O5
Molecular Weight329.31 g/mol
Exact Mass329.10
IUPAC NameN'-[2-(4-nitrophenoxy)acetyl]-2-phenylacetohydrazide
SMILESO=C(COc1ccc([N+](=O)[O-])cc1)NNC(=O)Cc1ccccc1
InChIInChI=1S/C16H15N3O5/c20-15(10-12-4-2-1-3-5-12)17-18-16(21)11-24-14-8-6-13(7-9-14)19(22)23/h1-9H,10-11H2,(H,17,20)(H,18,21)
InChIKeyLARZERYSEOVRBZ-UHFFFAOYSA-N
XLogP1.36
TPSA110.57 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.31
LogP ≤ 51.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

1-(4-nitrophenoxy)-3-phenylpropan-2-one
CID 61031518
2-(4-nitrophenoxy)-N-phenylmethoxyacetamide
CID 41248168
2-(4-nitrophenoxy)-N'-phenylacetohydrazide
CID 739659
N-(4-nitrophenyl)-2-(4-phenylmethoxyphenoxy)acetamide
CID 3114321
2-(4-nitrophenoxy)-N-phenylacetamide
CID 923397
N'-[2-(4-methylphenoxy)acetyl]-2-phenylacetohydrazide
CID 968398
N'-[2-(4-nitrophenoxy)acetyl]butanehydrazide
CID 3510439
2-(4-nitrophenoxy)-N-[(2R)-4-phenylbutan-2-yl]acetamide
CID 2632338
N-[2-(4-nitrophenyl)ethyl]-2-phenoxyacetamide
CID 19166772
N'-[2-(4-nitrophenoxy)acetyl]-3-(2-phenylethoxy)benzohydrazide
CID 17134509
N'-[2-(4-nitrophenoxy)acetyl]-2-(4-propan-2-ylphenoxy)acetohydrazide
CID 4502703
N-(2,2-diphenylethyl)-2-(4-nitrophenoxy)acetamide
CID 41161668

Frequently Asked Questions

What is the IUPAC name of N'-[2-(4-nitrophenoxy)acetyl]-2-phenylacetohydrazide?
The IUPAC name of N'-[2-(4-nitrophenoxy)acetyl]-2-phenylacetohydrazide (CID 922307) is N'-[2-(4-nitrophenoxy)acetyl]-2-phenylacetohydrazide.
What is the SMILES notation for N'-[2-(4-nitrophenoxy)acetyl]-2-phenylacetohydrazide?
The canonical SMILES for N'-[2-(4-nitrophenoxy)acetyl]-2-phenylacetohydrazide is O=C(COc1ccc([N+](=O)[O-])cc1)NNC(=O)Cc1ccccc1.
What is the InChIKey of N'-[2-(4-nitrophenoxy)acetyl]-2-phenylacetohydrazide?
The InChIKey is LARZERYSEOVRBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O5/c20-15(10-12-4-2-1-3-5-12)17-18-16(21)11-24-14-8-6-13(7-9-14)19(22)23/h1-9H,10-11H2,(H,17,20)(H,18,21).
What are the key properties of N'-[2-(4-nitrophenoxy)acetyl]-2-phenylacetohydrazide?
N'-[2-(4-nitrophenoxy)acetyl]-2-phenylacetohydrazide has a molecular weight of 329.31 g/mol, XLogP of 1.36, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-(4-nitrophenoxy)acetyl]-2-phenylacetohydrazide is sourced from PubChem (CID 922307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).