methyl 2-hydrazinyl-2-phenylpropanoate

C10H14N2O2 — CID 146190262

IUPACmethyl 2-hydrazinyl-2-phenylpropanoate
SMILESCOC(=O)C(C)(NN)c1ccccc1
InChIInChI=1S/C10H14N2O2/c1-10(12-11,9(13)14-2)8-6-4-3-5-7-8/h3-7,12H,11H2,1-2H3
InChIKeyOKUIZGJXZRHPDN-UHFFFAOYSA-N
MW194.23 g/mol
LogP0.54
Rot. Bonds3

About methyl 2-hydrazinyl-2-phenylpropanoate

methyl 2-hydrazinyl-2-phenylpropanoate (PubChem CID 146190262) has the molecular formula C10H14N2O2 and a molecular weight of 194.23 g/mol. Its IUPAC name is methyl 2-hydrazinyl-2-phenylpropanoate.

Molecular Properties

Compound Namemethyl 2-hydrazinyl-2-phenylpropanoate
PubChem CID146190262
Molecular FormulaC10H14N2O2
Molecular Weight194.23 g/mol
Exact Mass194.11
IUPAC Namemethyl 2-hydrazinyl-2-phenylpropanoate
SMILESCOC(=O)C(C)(NN)c1ccccc1
InChIInChI=1S/C10H14N2O2/c1-10(12-11,9(13)14-2)8-6-4-3-5-7-8/h3-7,12H,11H2,1-2H3
InChIKeyOKUIZGJXZRHPDN-UHFFFAOYSA-N
XLogP0.54
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 50.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

methyl 2-(3-fluorophenyl)-2-hydrazinylpropanoate
CID 146310495
methyl 2-hydrazinyl-2-(3-methoxyphenyl)propanoate;hydrochloride
CID 155757771
methyl 2-(4-methylanilino)-2-phenylpropanoate
CID 60990669
methyl 2-hydrazinyl-2-(2-methoxyphenyl)propanoate
CID 146328018
methyl (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-2-phenylpropanoate
CID 15384695
methyl (2R)-2-amino-2-phenylpropanoate;hydrochloride
CID 141027321
methyl 2-(2-methoxyethylamino)-2-phenylpropanoate
CID 62541706
methyl 2-(3-chloroanilino)-2-phenylpropanoate
CID 60991426
methyl (2R,3R)-3-fluoro-2-hydroxy-2-methyl-3-phenylbutanoate
CID 23234237
methyl 2,2-dibromo-2-phenylacetate
CID 59974916
(2R)-2-amino-3-methoxy-3-oxo-2-phenylpropanoic acid
CID 66823925
methyl 2-anilino-2-(4-hydroxyphenyl)propanoate
CID 60991506

Frequently Asked Questions

What is the IUPAC name of methyl 2-hydrazinyl-2-phenylpropanoate?
The IUPAC name of methyl 2-hydrazinyl-2-phenylpropanoate (CID 146190262) is methyl 2-hydrazinyl-2-phenylpropanoate.
What is the SMILES notation for methyl 2-hydrazinyl-2-phenylpropanoate?
The canonical SMILES for methyl 2-hydrazinyl-2-phenylpropanoate is COC(=O)C(C)(NN)c1ccccc1.
What is the InChIKey of methyl 2-hydrazinyl-2-phenylpropanoate?
The InChIKey is OKUIZGJXZRHPDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O2/c1-10(12-11,9(13)14-2)8-6-4-3-5-7-8/h3-7,12H,11H2,1-2H3.
What are the key properties of methyl 2-hydrazinyl-2-phenylpropanoate?
methyl 2-hydrazinyl-2-phenylpropanoate has a molecular weight of 194.23 g/mol, XLogP of 0.54, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-hydrazinyl-2-phenylpropanoate is sourced from PubChem (CID 146190262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).