methyl 2-amino-2-(6-methoxynaphthalen-2-yl)acetate

C14H15NO3 — CID 54022420

IUPACmethyl 2-amino-2-(6-methoxynaphthalen-2-yl)acetate
SMILESCOC(=O)C(N)c1ccc2cc(OC)ccc2c1
InChIInChI=1S/C14H15NO3/c1-17-12-6-5-9-7-11(4-3-10(9)8-12)13(15)14(16)18-2/h3-8,13H,15H2,1-2H3
InChIKeyKZWAGLBEIIQOCE-UHFFFAOYSA-N
MW245.28 g/mol
LogP2.02
Rot. Bonds3

About methyl 2-amino-2-(6-methoxynaphthalen-2-yl)acetate

methyl 2-amino-2-(6-methoxynaphthalen-2-yl)acetate (PubChem CID 54022420) has the molecular formula C14H15NO3 and a molecular weight of 245.28 g/mol. Its IUPAC name is methyl 2-amino-2-(6-methoxynaphthalen-2-yl)acetate.

Molecular Properties

Compound Namemethyl 2-amino-2-(6-methoxynaphthalen-2-yl)acetate
PubChem CID54022420
Molecular FormulaC14H15NO3
Molecular Weight245.28 g/mol
Exact Mass245.11
IUPAC Namemethyl 2-amino-2-(6-methoxynaphthalen-2-yl)acetate
SMILESCOC(=O)C(N)c1ccc2cc(OC)ccc2c1
InChIInChI=1S/C14H15NO3/c1-17-12-6-5-9-7-11(4-3-10(9)8-12)13(15)14(16)18-2/h3-8,13H,15H2,1-2H3
InChIKeyKZWAGLBEIIQOCE-UHFFFAOYSA-N
XLogP2.02
TPSA61.55 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.28
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-2-(6-methoxynaphthalen-2-yl)-N'-methylacetohydrazide
CID 116849464
2-amino-2-(6-methoxynaphthalen-2-yl)-N-methylacetohydrazide
CID 116849020
methyl (2R)-2-amino-2-(3-methoxyphenyl)acetate;hydrochloride
CID 171219744
amino-(6-methoxynaphthalen-2-yl)methanol
CID 116939708
(3R)-3-amino-3-(6-methoxynaphthalen-2-yl)propanamide
CID 29060145
methoxy-(6-methoxynaphthalen-2-yl)methanamine
CID 116947369
tert-butyl (2R)-2-amino-2-(4-methoxyphenyl)acetate
CID 92840712
tert-butyl (2S)-2-amino-2-(4-methoxyphenyl)acetate
CID 92840713
3-(6-methoxynaphthalen-2-yl)butan-2-one
CID 13292512
chloro (2S)-2-(6-methoxynaphthalen-2-yl)propanoate
CID 90693422
1-(6-methoxynaphthalen-2-yl)-1-(methylamino)propan-2-one
CID 116955950
(2S)-N-hydroxy-2-(6-methoxynaphthalen-2-yl)propanamide
CID 92850098

Frequently Asked Questions

What is the IUPAC name of methyl 2-amino-2-(6-methoxynaphthalen-2-yl)acetate?
The IUPAC name of methyl 2-amino-2-(6-methoxynaphthalen-2-yl)acetate (CID 54022420) is methyl 2-amino-2-(6-methoxynaphthalen-2-yl)acetate.
What is the SMILES notation for methyl 2-amino-2-(6-methoxynaphthalen-2-yl)acetate?
The canonical SMILES for methyl 2-amino-2-(6-methoxynaphthalen-2-yl)acetate is COC(=O)C(N)c1ccc2cc(OC)ccc2c1.
What is the InChIKey of methyl 2-amino-2-(6-methoxynaphthalen-2-yl)acetate?
The InChIKey is KZWAGLBEIIQOCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO3/c1-17-12-6-5-9-7-11(4-3-10(9)8-12)13(15)14(16)18-2/h3-8,13H,15H2,1-2H3.
What are the key properties of methyl 2-amino-2-(6-methoxynaphthalen-2-yl)acetate?
methyl 2-amino-2-(6-methoxynaphthalen-2-yl)acetate has a molecular weight of 245.28 g/mol, XLogP of 2.02, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-amino-2-(6-methoxynaphthalen-2-yl)acetate is sourced from PubChem (CID 54022420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).