methyl 2-(5-hydrazinyl-2-methylphenyl)acetate

C10H14N2O2 — CID 130777805

IUPACmethyl 2-(5-hydrazinyl-2-methylphenyl)acetate
SMILESCOC(=O)Cc1cc(NN)ccc1C
InChIInChI=1S/C10H14N2O2/c1-7-3-4-9(12-11)5-8(7)6-10(13)14-2/h3-5,12H,6,11H2,1-2H3
InChIKeyPXZAQHBESIUYND-UHFFFAOYSA-N
MW194.23 g/mol
LogP1.00
Rot. Bonds3

About methyl 2-(5-hydrazinyl-2-methylphenyl)acetate

methyl 2-(5-hydrazinyl-2-methylphenyl)acetate (PubChem CID 130777805) has the molecular formula C10H14N2O2 and a molecular weight of 194.23 g/mol. Its IUPAC name is methyl 2-(5-hydrazinyl-2-methylphenyl)acetate.

Molecular Properties

Compound Namemethyl 2-(5-hydrazinyl-2-methylphenyl)acetate
PubChem CID130777805
Molecular FormulaC10H14N2O2
Molecular Weight194.23 g/mol
Exact Mass194.11
IUPAC Namemethyl 2-(5-hydrazinyl-2-methylphenyl)acetate
SMILESCOC(=O)Cc1cc(NN)ccc1C
InChIInChI=1S/C10H14N2O2/c1-7-3-4-9(12-11)5-8(7)6-10(13)14-2/h3-5,12H,6,11H2,1-2H3
InChIKeyPXZAQHBESIUYND-UHFFFAOYSA-N
XLogP1.00
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 ≤ 51.00
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-(5-methoxy-2-methylphenyl)acetate
CID 170997183
4-methylbenzene-1,3-diamine;methyl 2-[5-(methoxycarbonylamino)-2-methylphenyl]acetate
CID 163530490
methyl 3-(2-methoxy-2-oxoethyl)-4-methylbenzoate
CID 59212520
methyl 2-(5-tert-butyl-2-methylphenyl)acetate
CID 82127657
ethane;methyl 2-(2-methylphenyl)acetate
CID 142489189
methyl 2-(4-amino-5-fluoro-2-methylphenyl)acetate
CID 131302688
methyl 2-[4-(aminomethyl)-5-cyano-2-methylphenyl]acetate
CID 134635196
methyl 2-(2-hydrazinyl-4-sulfanylphenyl)acetate
CID 130960952
methyl 2-[(2,5-dimethylphenyl)methylamino]acetate
CID 60687577
methyl 2-[(2,5-dimethylphenyl)methylsulfanyl]acetate
CID 78765913
methyl 2-(2-chloro-5-methylphenyl)acetate
CID 86187737
methyl 2-[2-(3-chloro-2-oxopropyl)-5-methylphenyl]acetate
CID 134614159

Frequently Asked Questions

What is the IUPAC name of methyl 2-(5-hydrazinyl-2-methylphenyl)acetate?
The IUPAC name of methyl 2-(5-hydrazinyl-2-methylphenyl)acetate (CID 130777805) is methyl 2-(5-hydrazinyl-2-methylphenyl)acetate.
What is the SMILES notation for methyl 2-(5-hydrazinyl-2-methylphenyl)acetate?
The canonical SMILES for methyl 2-(5-hydrazinyl-2-methylphenyl)acetate is COC(=O)Cc1cc(NN)ccc1C.
What is the InChIKey of methyl 2-(5-hydrazinyl-2-methylphenyl)acetate?
The InChIKey is PXZAQHBESIUYND-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O2/c1-7-3-4-9(12-11)5-8(7)6-10(13)14-2/h3-5,12H,6,11H2,1-2H3.
What are the key properties of methyl 2-(5-hydrazinyl-2-methylphenyl)acetate?
methyl 2-(5-hydrazinyl-2-methylphenyl)acetate has a molecular weight of 194.23 g/mol, XLogP of 1.00, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-(5-hydrazinyl-2-methylphenyl)acetate is sourced from PubChem (CID 130777805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).