methyl 2-amino-2-(3-ethoxyphenyl)acetate

C11H15NO3 — CID 60874468

IUPACmethyl 2-amino-2-(3-ethoxyphenyl)acetate
SMILESCCOc1cccc(C(N)C(=O)OC)c1
InChIInChI=1S/C11H15NO3/c1-3-15-9-6-4-5-8(7-9)10(12)11(13)14-2/h4-7,10H,3,12H2,1-2H3
InChIKeyRXKMFVUFZHCFNL-UHFFFAOYSA-N
MW209.24 g/mol
LogP1.26
Rot. Bonds4

About methyl 2-amino-2-(3-ethoxyphenyl)acetate

methyl 2-amino-2-(3-ethoxyphenyl)acetate (PubChem CID 60874468) has the molecular formula C11H15NO3 and a molecular weight of 209.24 g/mol. Its IUPAC name is methyl 2-amino-2-(3-ethoxyphenyl)acetate.

Molecular Properties

Compound Namemethyl 2-amino-2-(3-ethoxyphenyl)acetate
PubChem CID60874468
Molecular FormulaC11H15NO3
Molecular Weight209.24 g/mol
Exact Mass209.11
IUPAC Namemethyl 2-amino-2-(3-ethoxyphenyl)acetate
SMILESCCOc1cccc(C(N)C(=O)OC)c1
InChIInChI=1S/C11H15NO3/c1-3-15-9-6-4-5-8(7-9)10(12)11(13)14-2/h4-7,10H,3,12H2,1-2H3
InChIKeyRXKMFVUFZHCFNL-UHFFFAOYSA-N
XLogP1.26
TPSA61.55 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.24
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

methyl (2S)-2-amino-2-(3-ethoxyphenyl)acetate;hydrochloride
CID 171205678
(2R)-2-amino-2-(3-ethoxyphenyl)acetic acid
CID 7046833
methyl (2R)-2-amino-2-(3-methoxyphenyl)acetate;hydrochloride
CID 171219744
methyl 2-(3-ethoxyphenyl)-3-oxobutanoate
CID 112512277
methyl 2-(3-ethoxyphenyl)-2-(methylamino)acetate
CID 60873905
methyl (3R)-3-amino-3-(3-ethoxyphenyl)propanoate;hydrochloride
CID 171248203
methyl 2-(3-ethoxyphenyl)-2-(propan-2-ylamino)acetate
CID 60873533
3-amino-3-(3-ethoxyphenyl)-N-ethylpropanamide
CID 112508347
methyl 2-(3-ethoxyphenoxy)propanoate
CID 62338439
2-amino-3-(3-ethoxyphenyl)-3-hydroxypropanoic acid
CID 66204925
3-(3-ethoxyphenyl)pentanediamide
CID 20546636
methyl 2-amino-2-(3-propan-2-ylphenyl)acetate
CID 20824071

Frequently Asked Questions

What is the IUPAC name of methyl 2-amino-2-(3-ethoxyphenyl)acetate?
The IUPAC name of methyl 2-amino-2-(3-ethoxyphenyl)acetate (CID 60874468) is methyl 2-amino-2-(3-ethoxyphenyl)acetate.
What is the SMILES notation for methyl 2-amino-2-(3-ethoxyphenyl)acetate?
The canonical SMILES for methyl 2-amino-2-(3-ethoxyphenyl)acetate is CCOc1cccc(C(N)C(=O)OC)c1.
What is the InChIKey of methyl 2-amino-2-(3-ethoxyphenyl)acetate?
The InChIKey is RXKMFVUFZHCFNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO3/c1-3-15-9-6-4-5-8(7-9)10(12)11(13)14-2/h4-7,10H,3,12H2,1-2H3.
What are the key properties of methyl 2-amino-2-(3-ethoxyphenyl)acetate?
methyl 2-amino-2-(3-ethoxyphenyl)acetate has a molecular weight of 209.24 g/mol, XLogP of 1.26, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-amino-2-(3-ethoxyphenyl)acetate is sourced from PubChem (CID 60874468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).