2-[2-methoxyethyl-(2-pyrrolidin-2-ylacetyl)amino]acetic acid

C11H20N2O4 — CID 79271684

IUPAC2-[2-methoxyethyl-(2-pyrrolidin-2-ylacetyl)amino]acetic acid
SMILESCOCCN(CC(=O)O)C(=O)CC1CCCN1
InChIInChI=1S/C11H20N2O4/c1-17-6-5-13(8-11(15)16)10(14)7-9-3-2-4-12-9/h9,12H,2-8H2,1H3,(H,15,16)
InChIKeyFMHIWIFAAJAZRQ-UHFFFAOYSA-N
MW244.29 g/mol
LogP-0.31
Rot. Bonds7

About 2-[2-methoxyethyl-(2-pyrrolidin-2-ylacetyl)amino]acetic acid

2-[2-methoxyethyl-(2-pyrrolidin-2-ylacetyl)amino]acetic acid (PubChem CID 79271684) has the molecular formula C11H20N2O4 and a molecular weight of 244.29 g/mol. Its IUPAC name is 2-[2-methoxyethyl-(2-pyrrolidin-2-ylacetyl)amino]acetic acid.

Molecular Properties

Compound Name2-[2-methoxyethyl-(2-pyrrolidin-2-ylacetyl)amino]acetic acid
PubChem CID79271684
Molecular FormulaC11H20N2O4
Molecular Weight244.29 g/mol
Exact Mass244.14
IUPAC Name2-[2-methoxyethyl-(2-pyrrolidin-2-ylacetyl)amino]acetic acid
SMILESCOCCN(CC(=O)O)C(=O)CC1CCCN1
InChIInChI=1S/C11H20N2O4/c1-17-6-5-13(8-11(15)16)10(14)7-9-3-2-4-12-9/h9,12H,2-8H2,1H3,(H,15,16)
InChIKeyFMHIWIFAAJAZRQ-UHFFFAOYSA-N
XLogP-0.31
TPSA78.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 5-0.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[2-methoxyethyl-[(2R)-pyrrolidine-2-carbonyl]amino]acetic acid
CID 103869714
N-(2-methoxyethyl)-N-(pyrrolidin-2-ylmethyl)propanamide
CID 106611566
N-(2-methoxyethyl)-2-pyrrolidin-2-yl-N-(thiophen-2-ylmethyl)acetamide
CID 61365241
N-(2-methoxyethyl)-N-(pyrrolidin-2-ylmethyl)butanamide
CID 106611388
N-benzyl-N-(4-methoxybutyl)-2-pyrrolidin-2-ylacetamide
CID 119752528
N-benzyl-N-(4-methoxybutyl)-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119752527
2-[2-methoxyethyl-(2-piperidin-4-yloxyacetyl)amino]acetic acid
CID 79271103
N-(2-methoxyethyl)-N-(pyrrolidin-2-ylmethyl)but-2-ynamide
CID 107990936
2-ethyl-N-(2-methoxyethyl)-N-(pyrrolidin-2-ylmethyl)butanamide
CID 106611787
N,N-dimethyl-2-[(2R)-pyrrolidin-2-yl]acetamide
CID 66777504
2-[2-methoxyethyl(pyrrolidin-2-ylmethyl)amino]propanoic acid
CID 106617509
methyl 2-[benzyl-(2-pyrrolidin-2-ylacetyl)amino]acetate
CID 61366041

Frequently Asked Questions

What is the IUPAC name of 2-[2-methoxyethyl-(2-pyrrolidin-2-ylacetyl)amino]acetic acid?
The IUPAC name of 2-[2-methoxyethyl-(2-pyrrolidin-2-ylacetyl)amino]acetic acid (CID 79271684) is 2-[2-methoxyethyl-(2-pyrrolidin-2-ylacetyl)amino]acetic acid.
What is the SMILES notation for 2-[2-methoxyethyl-(2-pyrrolidin-2-ylacetyl)amino]acetic acid?
The canonical SMILES for 2-[2-methoxyethyl-(2-pyrrolidin-2-ylacetyl)amino]acetic acid is COCCN(CC(=O)O)C(=O)CC1CCCN1.
What is the InChIKey of 2-[2-methoxyethyl-(2-pyrrolidin-2-ylacetyl)amino]acetic acid?
The InChIKey is FMHIWIFAAJAZRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O4/c1-17-6-5-13(8-11(15)16)10(14)7-9-3-2-4-12-9/h9,12H,2-8H2,1H3,(H,15,16).
What are the key properties of 2-[2-methoxyethyl-(2-pyrrolidin-2-ylacetyl)amino]acetic acid?
2-[2-methoxyethyl-(2-pyrrolidin-2-ylacetyl)amino]acetic acid has a molecular weight of 244.29 g/mol, XLogP of -0.31, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-methoxyethyl-(2-pyrrolidin-2-ylacetyl)amino]acetic acid is sourced from PubChem (CID 79271684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).