2-[2-methoxyethyl-[(2R)-pyrrolidine-2-carbonyl]amino]acetic acid

C10H18N2O4 — CID 103869714

IUPAC2-[2-methoxyethyl-[(2R)-pyrrolidine-2-carbonyl]amino]acetic acid
SMILESCOCCN(CC(=O)O)C(=O)[C@H]1CCCN1
InChIInChI=1S/C10H18N2O4/c1-16-6-5-12(7-9(13)14)10(15)8-3-2-4-11-8/h8,11H,2-7H2,1H3,(H,13,14)/t8-/m1/s1
InChIKeyMNEDDCPZPFSMDH-MRVPVSSYSA-N
MW230.26 g/mol
LogP-0.70
Rot. Bonds6

About 2-[2-methoxyethyl-[(2R)-pyrrolidine-2-carbonyl]amino]acetic acid

2-[2-methoxyethyl-[(2R)-pyrrolidine-2-carbonyl]amino]acetic acid (PubChem CID 103869714) has the molecular formula C10H18N2O4 and a molecular weight of 230.26 g/mol. Its IUPAC name is 2-[2-methoxyethyl-[(2R)-pyrrolidine-2-carbonyl]amino]acetic acid.

Molecular Properties

Compound Name2-[2-methoxyethyl-[(2R)-pyrrolidine-2-carbonyl]amino]acetic acid
PubChem CID103869714
Molecular FormulaC10H18N2O4
Molecular Weight230.26 g/mol
Exact Mass230.13
IUPAC Name2-[2-methoxyethyl-[(2R)-pyrrolidine-2-carbonyl]amino]acetic acid
SMILESCOCCN(CC(=O)O)C(=O)[C@H]1CCCN1
InChIInChI=1S/C10H18N2O4/c1-16-6-5-12(7-9(13)14)10(15)8-3-2-4-11-8/h8,11H,2-7H2,1H3,(H,13,14)/t8-/m1/s1
InChIKeyMNEDDCPZPFSMDH-MRVPVSSYSA-N
XLogP-0.70
TPSA78.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.26
LogP ≤ 5-0.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[propyl-[(2R)-pyrrolidine-2-carbonyl]amino]acetic acid
CID 103869567
N-(2-cyanoethyl)-N-(2-methoxyethyl)pyrrolidine-2-carboxamide
CID 63286424
2-[2-methoxyethyl-(2-pyrrolidin-2-ylacetyl)amino]acetic acid
CID 79271684
(2S)-N-(2-methoxyethyl)-N-methylpyrrolidine-2-carboxamide;hydrochloride
CID 68805915
(2R)-N-[3-(dimethylamino)propyl]-N-(2-methoxyethyl)piperidine-2-carboxamide
CID 93376713
N-[3-(dimethylamino)propyl]-N-(2-methoxyethyl)piperidine-2-carboxamide
CID 54874369
N-butyl-N-(2-methoxyethyl)piperidine-2-carboxamide;hydrochloride
CID 119322175
2-[2-methylpropyl-[(2R)-pyrrolidine-2-carbonyl]amino]acetic acid
CID 103869277
2-[ethyl-[(2R)-piperidine-2-carbonyl]amino]acetic acid
CID 104913780
methyl 2-[propyl-[(2S)-pyrrolidine-2-carbonyl]amino]acetate
CID 61165277
(2S)-N-(2-methoxyethyl)-N-pentan-3-ylpyrrolidine-2-carboxamide
CID 61163560
2-[2,3,3a,4,5,6,7,7a-octahydro-1H-indole-2-carbonyl(2-methoxyethyl)amino]acetic acid
CID 79270937

Frequently Asked Questions

What is the IUPAC name of 2-[2-methoxyethyl-[(2R)-pyrrolidine-2-carbonyl]amino]acetic acid?
The IUPAC name of 2-[2-methoxyethyl-[(2R)-pyrrolidine-2-carbonyl]amino]acetic acid (CID 103869714) is 2-[2-methoxyethyl-[(2R)-pyrrolidine-2-carbonyl]amino]acetic acid.
What is the SMILES notation for 2-[2-methoxyethyl-[(2R)-pyrrolidine-2-carbonyl]amino]acetic acid?
The canonical SMILES for 2-[2-methoxyethyl-[(2R)-pyrrolidine-2-carbonyl]amino]acetic acid is COCCN(CC(=O)O)C(=O)[C@H]1CCCN1.
What is the InChIKey of 2-[2-methoxyethyl-[(2R)-pyrrolidine-2-carbonyl]amino]acetic acid?
The InChIKey is MNEDDCPZPFSMDH-MRVPVSSYSA-N. The full InChI is InChI=1S/C10H18N2O4/c1-16-6-5-12(7-9(13)14)10(15)8-3-2-4-11-8/h8,11H,2-7H2,1H3,(H,13,14)/t8-/m1/s1.
What are the key properties of 2-[2-methoxyethyl-[(2R)-pyrrolidine-2-carbonyl]amino]acetic acid?
2-[2-methoxyethyl-[(2R)-pyrrolidine-2-carbonyl]amino]acetic acid has a molecular weight of 230.26 g/mol, XLogP of -0.70, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-methoxyethyl-[(2R)-pyrrolidine-2-carbonyl]amino]acetic acid is sourced from PubChem (CID 103869714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).