methyl 2-[2-(2-methoxyacetyl)hydrazinyl]-2,2-diphenylacetate

C18H20N2O4 — CID 20696173

IUPACmethyl 2-[2-(2-methoxyacetyl)hydrazinyl]-2,2-diphenylacetate
SMILESCOCC(=O)NNC(C(=O)OC)(c1ccccc1)c1ccccc1
InChIInChI=1S/C18H20N2O4/c1-23-13-16(21)19-20-18(17(22)24-2,14-9-5-3-6-10-14)15-11-7-4-8-12-15/h3-12,20H,13H2,1-2H3,(H,19,21)
InChIKeyMBPBOZGXYCKGIL-UHFFFAOYSA-N
MW328.37 g/mol
LogP1.37
Rot. Bonds7

About methyl 2-[2-(2-methoxyacetyl)hydrazinyl]-2,2-diphenylacetate

methyl 2-[2-(2-methoxyacetyl)hydrazinyl]-2,2-diphenylacetate (PubChem CID 20696173) has the molecular formula C18H20N2O4 and a molecular weight of 328.37 g/mol. Its IUPAC name is methyl 2-[2-(2-methoxyacetyl)hydrazinyl]-2,2-diphenylacetate.

Molecular Properties

Compound Namemethyl 2-[2-(2-methoxyacetyl)hydrazinyl]-2,2-diphenylacetate
PubChem CID20696173
Molecular FormulaC18H20N2O4
Molecular Weight328.37 g/mol
Exact Mass328.14
IUPAC Namemethyl 2-[2-(2-methoxyacetyl)hydrazinyl]-2,2-diphenylacetate
SMILESCOCC(=O)NNC(C(=O)OC)(c1ccccc1)c1ccccc1
InChIInChI=1S/C18H20N2O4/c1-23-13-16(21)19-20-18(17(22)24-2,14-9-5-3-6-10-14)15-11-7-4-8-12-15/h3-12,20H,13H2,1-2H3,(H,19,21)
InChIKeyMBPBOZGXYCKGIL-UHFFFAOYSA-N
XLogP1.37
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.37
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

dimethyl 2,3-diphenyl-2,3-bis(trimethylsilyloxy)butanedioate
CID 11826857
methyl 2,2-dibromo-2-phenylacetate
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methyl (2R)-2-(methoxymethyl)-2-methyl-3-trityloxypropanoate
CID 124849278
methyl 2-fluoro-2,2-diphenylacetate
CID 13222568
methyl 2,2-diphenyl-2-(pyridin-2-ylmethylamino)acetate
CID 162399408
methyl (2S)-3-bromo-2-hydroxy-2-phenylpropanoate
CID 99866628
methyl 2-methyl-2-phenylbutanoate
CID 562613
methyl 2,2-diphenyl-2-pyrrolidin-1-ylacetate
CID 90989848
2-methoxy-N-(2-methyl-1-phenylpropan-2-yl)acetamide
CID 84570069
2-methoxy-N-methylacetamide;phenylmethanol
CID 162215011
CID 91481469
CID 91481469
methyl (2R)-2-(4-aminophenyl)-2-phenyl-2-(prop-2-enylamino)acetate
CID 135143039

Frequently Asked Questions

What is the IUPAC name of methyl 2-[2-(2-methoxyacetyl)hydrazinyl]-2,2-diphenylacetate?
The IUPAC name of methyl 2-[2-(2-methoxyacetyl)hydrazinyl]-2,2-diphenylacetate (CID 20696173) is methyl 2-[2-(2-methoxyacetyl)hydrazinyl]-2,2-diphenylacetate.
What is the SMILES notation for methyl 2-[2-(2-methoxyacetyl)hydrazinyl]-2,2-diphenylacetate?
The canonical SMILES for methyl 2-[2-(2-methoxyacetyl)hydrazinyl]-2,2-diphenylacetate is COCC(=O)NNC(C(=O)OC)(c1ccccc1)c1ccccc1.
What is the InChIKey of methyl 2-[2-(2-methoxyacetyl)hydrazinyl]-2,2-diphenylacetate?
The InChIKey is MBPBOZGXYCKGIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O4/c1-23-13-16(21)19-20-18(17(22)24-2,14-9-5-3-6-10-14)15-11-7-4-8-12-15/h3-12,20H,13H2,1-2H3,(H,19,21).
What are the key properties of methyl 2-[2-(2-methoxyacetyl)hydrazinyl]-2,2-diphenylacetate?
methyl 2-[2-(2-methoxyacetyl)hydrazinyl]-2,2-diphenylacetate has a molecular weight of 328.37 g/mol, XLogP of 1.37, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-[2-(2-methoxyacetyl)hydrazinyl]-2,2-diphenylacetate is sourced from PubChem (CID 20696173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).