methyl 2-[[2-(1-methoxycyclobutyl)acetyl]-methylamino]acetate

C11H19NO4 — CID 103520057

IUPACmethyl 2-[[2-(1-methoxycyclobutyl)acetyl]-methylamino]acetate
SMILESCOC(=O)CN(C)C(=O)CC1(OC)CCC1
InChIInChI=1S/C11H19NO4/c1-12(8-10(14)15-2)9(13)7-11(16-3)5-4-6-11/h4-8H2,1-3H3
InChIKeyPBGCJNNVLUTYDB-UHFFFAOYSA-N
MW229.28 g/mol
LogP0.58
Rot. Bonds5

About methyl 2-[[2-(1-methoxycyclobutyl)acetyl]-methylamino]acetate

methyl 2-[[2-(1-methoxycyclobutyl)acetyl]-methylamino]acetate (PubChem CID 103520057) has the molecular formula C11H19NO4 and a molecular weight of 229.28 g/mol. Its IUPAC name is methyl 2-[[2-(1-methoxycyclobutyl)acetyl]-methylamino]acetate.

Molecular Properties

Compound Namemethyl 2-[[2-(1-methoxycyclobutyl)acetyl]-methylamino]acetate
PubChem CID103520057
Molecular FormulaC11H19NO4
Molecular Weight229.28 g/mol
Exact Mass229.13
IUPAC Namemethyl 2-[[2-(1-methoxycyclobutyl)acetyl]-methylamino]acetate
SMILESCOC(=O)CN(C)C(=O)CC1(OC)CCC1
InChIInChI=1S/C11H19NO4/c1-12(8-10(14)15-2)9(13)7-11(16-3)5-4-6-11/h4-8H2,1-3H3
InChIKeyPBGCJNNVLUTYDB-UHFFFAOYSA-N
XLogP0.58
TPSA55.84 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.28
LogP ≤ 50.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-bromo-3-methoxypropyl)-2-(1-methoxycyclobutyl)-N-methylacetamide
CID 103558209
methyl 2-[methyl(propanoyl)amino]acetate
CID 43407357
2-[[2-(1-methoxycyclobutyl)acetyl]-propan-2-ylamino]acetic acid
CID 103555539
methyl 2-(1-ethoxycyclobutyl)acetate
CID 103272473
2-(1-methoxycyclobutyl)acetohydrazide
CID 103555801
N-ethyl-N-(2-hydroxyethyl)-2-(1-methoxycyclobutyl)acetamide
CID 103520103
2-(1-methoxycyclobutyl)-N-methyl-N-(morpholin-2-ylmethyl)acetamide
CID 103557364
N-[(3-bromophenyl)methyl]-2-(1-methoxycyclobutyl)-N-methylacetamide
CID 103520091
diethyl 2-[[2-(1-methoxycyclobutyl)acetyl]amino]propanedioate
CID 103519956
5-[[[2-(1-methoxycyclobutyl)acetyl]-methylamino]methyl]-2-methylfuran-3-carboxylic acid
CID 120687007
N-[(1-ethylcyclopentyl)methyl]-2-(1-methoxycyclobutyl)acetamide
CID 119047801
1-(1-methoxycyclobutyl)but-3-yn-2-one
CID 103558857

Frequently Asked Questions

What is the IUPAC name of methyl 2-[[2-(1-methoxycyclobutyl)acetyl]-methylamino]acetate?
The IUPAC name of methyl 2-[[2-(1-methoxycyclobutyl)acetyl]-methylamino]acetate (CID 103520057) is methyl 2-[[2-(1-methoxycyclobutyl)acetyl]-methylamino]acetate.
What is the SMILES notation for methyl 2-[[2-(1-methoxycyclobutyl)acetyl]-methylamino]acetate?
The canonical SMILES for methyl 2-[[2-(1-methoxycyclobutyl)acetyl]-methylamino]acetate is COC(=O)CN(C)C(=O)CC1(OC)CCC1.
What is the InChIKey of methyl 2-[[2-(1-methoxycyclobutyl)acetyl]-methylamino]acetate?
The InChIKey is PBGCJNNVLUTYDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO4/c1-12(8-10(14)15-2)9(13)7-11(16-3)5-4-6-11/h4-8H2,1-3H3.
What are the key properties of methyl 2-[[2-(1-methoxycyclobutyl)acetyl]-methylamino]acetate?
methyl 2-[[2-(1-methoxycyclobutyl)acetyl]-methylamino]acetate has a molecular weight of 229.28 g/mol, XLogP of 0.58, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-[[2-(1-methoxycyclobutyl)acetyl]-methylamino]acetate is sourced from PubChem (CID 103520057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).