(2S)-N-[2-(2-methoxyethylamino)-2-oxoethyl]pyrrolidine-2-carboxamide;hydrochloride

C10H20ClN3O3 — CID 119274176

IUPAC(2S)-N-[2-(2-methoxyethylamino)-2-oxoethyl]pyrrolidine-2-carboxamide;hydrochloride
SMILESCOCCNC(=O)CNC(=O)[C@@H]1CCCN1.Cl
InChIInChI=1S/C10H19N3O3.ClH/c1-16-6-5-12-9(14)7-13-10(15)8-3-2-4-11-8;/h8,11H,2-7H2,1H3,(H,12,14)(H,13,15);1H/t8-;/m0./s1
InChIKeyDEDIQIKUMSYTHP-QRPNPIFTSA-N
MW265.74 g/mol
LogP-0.96
Rot. Bonds6

About (2S)-N-[2-(2-methoxyethylamino)-2-oxoethyl]pyrrolidine-2-carboxamide;hydrochloride

(2S)-N-[2-(2-methoxyethylamino)-2-oxoethyl]pyrrolidine-2-carboxamide;hydrochloride (PubChem CID 119274176) has the molecular formula C10H20ClN3O3 and a molecular weight of 265.74 g/mol. Its IUPAC name is (2S)-N-[2-(2-methoxyethylamino)-2-oxoethyl]pyrrolidine-2-carboxamide;hydrochloride.

Molecular Properties

Compound Name(2S)-N-[2-(2-methoxyethylamino)-2-oxoethyl]pyrrolidine-2-carboxamide;hydrochloride
PubChem CID119274176
Molecular FormulaC10H20ClN3O3
Molecular Weight265.74 g/mol
Exact Mass265.12
IUPAC Name(2S)-N-[2-(2-methoxyethylamino)-2-oxoethyl]pyrrolidine-2-carboxamide;hydrochloride
SMILESCOCCNC(=O)CNC(=O)[C@@H]1CCCN1.Cl
InChIInChI=1S/C10H19N3O3.ClH/c1-16-6-5-12-9(14)7-13-10(15)8-3-2-4-11-8;/h8,11H,2-7H2,1H3,(H,12,14)(H,13,15);1H/t8-;/m0./s1
InChIKeyDEDIQIKUMSYTHP-QRPNPIFTSA-N
XLogP-0.96
TPSA79.46 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.74
LogP ≤ 5-0.96
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-[2-(2-methoxyethylamino)-2-oxoethyl]piperidine-2-carboxamide;hydrochloride
CID 119274167
N-[2-oxo-2-(propylamino)ethyl]pyrrolidine-2-carboxamide;hydrochloride
CID 119271449
(2S)-N-[2-oxo-2-[8-[[2-[[(2S)-pyrrolidine-2-carbonyl]amino]acetyl]amino]octylamino]ethyl]pyrrolidine-2-carboxamide
CID 102333341
N-[4-(2-methoxyethoxy)butyl]pyrrolidine-2-carboxamide
CID 115626529
N-[2-oxo-2-(propylamino)ethyl]piperidine-2-carboxamide
CID 43516914
(2S)-N-[2-(hydroxyamino)-2-oxoethyl]pyrrolidine-2-carboxamide
CID 10419946
(2S)-N-[2-(tert-butylamino)-2-oxoethyl]pyrrolidine-2-carboxamide;hydrochloride
CID 119272921
(2S)-N-[2-(2-methylpropylamino)-2-oxoethyl]pyrrolidine-2-carboxamide
CID 103796173
(2R)-N-[2-(2-hydroxyethoxy)ethyl]pyrrolidine-2-carboxamide
CID 104901055
N-[2-(tert-butylamino)-2-oxoethyl]pyrrolidine-2-carboxamide
CID 43419751
N-(2-ethoxyethyl)pyrrolidine-2-carboxamide
CID 43591374
N-(2-methoxyethyl)-2-[4-(pyrrolidine-2-carbonyl)piperazin-1-yl]acetamide;dihydrochloride
CID 119836395

Frequently Asked Questions

What is the IUPAC name of (2S)-N-[2-(2-methoxyethylamino)-2-oxoethyl]pyrrolidine-2-carboxamide;hydrochloride?
The IUPAC name of (2S)-N-[2-(2-methoxyethylamino)-2-oxoethyl]pyrrolidine-2-carboxamide;hydrochloride (CID 119274176) is (2S)-N-[2-(2-methoxyethylamino)-2-oxoethyl]pyrrolidine-2-carboxamide;hydrochloride.
What is the SMILES notation for (2S)-N-[2-(2-methoxyethylamino)-2-oxoethyl]pyrrolidine-2-carboxamide;hydrochloride?
The canonical SMILES for (2S)-N-[2-(2-methoxyethylamino)-2-oxoethyl]pyrrolidine-2-carboxamide;hydrochloride is COCCNC(=O)CNC(=O)[C@@H]1CCCN1.Cl.
What is the InChIKey of (2S)-N-[2-(2-methoxyethylamino)-2-oxoethyl]pyrrolidine-2-carboxamide;hydrochloride?
The InChIKey is DEDIQIKUMSYTHP-QRPNPIFTSA-N. The full InChI is InChI=1S/C10H19N3O3.ClH/c1-16-6-5-12-9(14)7-13-10(15)8-3-2-4-11-8;/h8,11H,2-7H2,1H3,(H,12,14)(H,13,15);1H/t8-;/m0./s1.
What are the key properties of (2S)-N-[2-(2-methoxyethylamino)-2-oxoethyl]pyrrolidine-2-carboxamide;hydrochloride?
(2S)-N-[2-(2-methoxyethylamino)-2-oxoethyl]pyrrolidine-2-carboxamide;hydrochloride has a molecular weight of 265.74 g/mol, XLogP of -0.96, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-[2-(2-methoxyethylamino)-2-oxoethyl]pyrrolidine-2-carboxamide;hydrochloride is sourced from PubChem (CID 119274176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).