2-[(3R)-3-aminopyrrolidin-1-yl]-N-(2-methoxyethyl)propanamide

C10H21N3O2 — CID 115302045

IUPAC2-[(3R)-3-aminopyrrolidin-1-yl]-N-(2-methoxyethyl)propanamide
SMILESCOCCNC(=O)C(C)N1CC[C@@H](N)C1
InChIInChI=1S/C10H21N3O2/c1-8(10(14)12-4-6-15-2)13-5-3-9(11)7-13/h8-9H,3-7,11H2,1-2H3,(H,12,14)/t8?,9-/m1/s1
InChIKeyQXZDTZIWSRFWDC-YGPZHTELSA-N
MW215.30 g/mol
LogP-0.83
Rot. Bonds5

About 2-[(3R)-3-aminopyrrolidin-1-yl]-N-(2-methoxyethyl)propanamide

2-[(3R)-3-aminopyrrolidin-1-yl]-N-(2-methoxyethyl)propanamide (PubChem CID 115302045) has the molecular formula C10H21N3O2 and a molecular weight of 215.30 g/mol. Its IUPAC name is 2-[(3R)-3-aminopyrrolidin-1-yl]-N-(2-methoxyethyl)propanamide.

Molecular Properties

Compound Name2-[(3R)-3-aminopyrrolidin-1-yl]-N-(2-methoxyethyl)propanamide
PubChem CID115302045
Molecular FormulaC10H21N3O2
Molecular Weight215.30 g/mol
Exact Mass215.16
IUPAC Name2-[(3R)-3-aminopyrrolidin-1-yl]-N-(2-methoxyethyl)propanamide
SMILESCOCCNC(=O)C(C)N1CC[C@@H](N)C1
InChIInChI=1S/C10H21N3O2/c1-8(10(14)12-4-6-15-2)13-5-3-9(11)7-13/h8-9H,3-7,11H2,1-2H3,(H,12,14)/t8?,9-/m1/s1
InChIKeyQXZDTZIWSRFWDC-YGPZHTELSA-N
XLogP-0.83
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.30
LogP ≤ 5-0.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-[1-(2-methoxyethylamino)-1-oxopropan-2-yl]pyrrolidine-3-carboxylic acid
CID 55150446
2-(3-aminopyrrolidin-1-yl)-N-butylpropanamide
CID 62068647
N-(2-methoxyethyl)-2-[3-[(2-methylpropylamino)methyl]piperidin-1-yl]propanamide
CID 63848663
2-[(3S)-3-aminopyrrolidin-1-yl]-N-propan-2-ylpropanamide
CID 81492569
2-[3-ethyl-4-(propylamino)piperidin-1-yl]-N-(2-methoxyethyl)propanamide
CID 114507664
2-[1-[1-(2-methoxyethylamino)-1-oxopropan-2-yl]piperidin-4-yl]oxyacetic acid
CID 63902809
2-[(3R)-3-aminopiperidin-1-yl]-N-ethylpropanamide
CID 102977439
2-(3-aminopyrrolidin-1-yl)-N-(ethylcarbamoyl)propanamide;hydrochloride
CID 119917700
2-[4-(3-aminopyrazol-1-yl)piperidin-1-yl]-N-(2-methoxyethyl)propanamide
CID 107109733
2-(3-aminopyrrolidin-1-yl)-N-(2-methylbutan-2-yl)propanamide
CID 62068958
(3S,4S)-1-[1-(2-methoxyethylamino)-1-oxopropan-2-yl]-4-methylpyrrolidine-3-carboxylic acid
CID 114086295
N-(2-methoxyethyl)-2-(3-piperazin-1-ylazetidin-1-yl)propanamide
CID 66196942

Frequently Asked Questions

What is the IUPAC name of 2-[(3R)-3-aminopyrrolidin-1-yl]-N-(2-methoxyethyl)propanamide?
The IUPAC name of 2-[(3R)-3-aminopyrrolidin-1-yl]-N-(2-methoxyethyl)propanamide (CID 115302045) is 2-[(3R)-3-aminopyrrolidin-1-yl]-N-(2-methoxyethyl)propanamide.
What is the SMILES notation for 2-[(3R)-3-aminopyrrolidin-1-yl]-N-(2-methoxyethyl)propanamide?
The canonical SMILES for 2-[(3R)-3-aminopyrrolidin-1-yl]-N-(2-methoxyethyl)propanamide is COCCNC(=O)C(C)N1CC[C@@H](N)C1.
What is the InChIKey of 2-[(3R)-3-aminopyrrolidin-1-yl]-N-(2-methoxyethyl)propanamide?
The InChIKey is QXZDTZIWSRFWDC-YGPZHTELSA-N. The full InChI is InChI=1S/C10H21N3O2/c1-8(10(14)12-4-6-15-2)13-5-3-9(11)7-13/h8-9H,3-7,11H2,1-2H3,(H,12,14)/t8?,9-/m1/s1.
What are the key properties of 2-[(3R)-3-aminopyrrolidin-1-yl]-N-(2-methoxyethyl)propanamide?
2-[(3R)-3-aminopyrrolidin-1-yl]-N-(2-methoxyethyl)propanamide has a molecular weight of 215.30 g/mol, XLogP of -0.83, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3R)-3-aminopyrrolidin-1-yl]-N-(2-methoxyethyl)propanamide is sourced from PubChem (CID 115302045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).