1-[2-(2-methoxyethylamino)acetyl]-N-methylpyrrolidine-2-carboxamide

C11H21N3O3 — CID 79282787

IUPAC1-[2-(2-methoxyethylamino)acetyl]-N-methylpyrrolidine-2-carboxamide
SMILESCNC(=O)C1CCCN1C(=O)CNCCOC
InChIInChI=1S/C11H21N3O3/c1-12-11(16)9-4-3-6-14(9)10(15)8-13-5-7-17-2/h9,13H,3-8H2,1-2H3,(H,12,16)
InChIKeyQJJHYZGTNBYEMA-UHFFFAOYSA-N
MW243.31 g/mol
LogP-1.04
Rot. Bonds6

About 1-[2-(2-methoxyethylamino)acetyl]-N-methylpyrrolidine-2-carboxamide

1-[2-(2-methoxyethylamino)acetyl]-N-methylpyrrolidine-2-carboxamide (PubChem CID 79282787) has the molecular formula C11H21N3O3 and a molecular weight of 243.31 g/mol. Its IUPAC name is 1-[2-(2-methoxyethylamino)acetyl]-N-methylpyrrolidine-2-carboxamide.

Molecular Properties

Compound Name1-[2-(2-methoxyethylamino)acetyl]-N-methylpyrrolidine-2-carboxamide
PubChem CID79282787
Molecular FormulaC11H21N3O3
Molecular Weight243.31 g/mol
Exact Mass243.16
IUPAC Name1-[2-(2-methoxyethylamino)acetyl]-N-methylpyrrolidine-2-carboxamide
SMILESCNC(=O)C1CCCN1C(=O)CNCCOC
InChIInChI=1S/C11H21N3O3/c1-12-11(16)9-4-3-6-14(9)10(15)8-13-5-7-17-2/h9,13H,3-8H2,1-2H3,(H,12,16)
InChIKeyQJJHYZGTNBYEMA-UHFFFAOYSA-N
XLogP-1.04
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 5-1.04
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

(2S)-1-[2-(2-methoxyethylamino)acetyl]pyrrolidine-2-carboxylic acid
CID 79281055
2-(2-methoxyethylamino)-1-(2-propan-2-ylpyrrolidin-1-yl)ethanone
CID 79290556
1-[2-(2-methoxyethylamino)acetyl]-N-methylpiperidine-3-carboxamide
CID 103811077
(2S)-1-(2-acetamidoacetyl)-N-methylpyrrolidine-2-carboxamide
CID 71346691
1-[2-(2-methoxyethylamino)acetyl]-N-(2-methoxy-5-methylphenyl)pyrrolidine-2-carboxamide
CID 119791330
1-butanoyl-N-methylpyrrolidine-2-carboxamide
CID 61060939
1-[2-(cyclopentylamino)acetyl]-N-methylpyrrolidine-2-carboxamide
CID 60952576
1-[(2S,3S)-2-(aminomethyl)-3-methylpiperidin-1-yl]-2-(2-methoxyethylamino)ethanone
CID 124685569
3-[2-(methylcarbamoyl)pyrrolidin-1-yl]-3-oxopropanoic acid
CID 62229916
N-methyl-1-[4-(methylamino)butanoyl]pyrrolidine-2-carboxamide;hydrochloride
CID 119736624
2-(2-methoxyethylamino)-1-(2-propan-2-ylpiperidin-1-yl)ethanone
CID 119788483
methyl 2-(methylcarbamoyl)pyrrolidine-1-carboxylate
CID 115606581

Frequently Asked Questions

What is the IUPAC name of 1-[2-(2-methoxyethylamino)acetyl]-N-methylpyrrolidine-2-carboxamide?
The IUPAC name of 1-[2-(2-methoxyethylamino)acetyl]-N-methylpyrrolidine-2-carboxamide (CID 79282787) is 1-[2-(2-methoxyethylamino)acetyl]-N-methylpyrrolidine-2-carboxamide.
What is the SMILES notation for 1-[2-(2-methoxyethylamino)acetyl]-N-methylpyrrolidine-2-carboxamide?
The canonical SMILES for 1-[2-(2-methoxyethylamino)acetyl]-N-methylpyrrolidine-2-carboxamide is CNC(=O)C1CCCN1C(=O)CNCCOC.
What is the InChIKey of 1-[2-(2-methoxyethylamino)acetyl]-N-methylpyrrolidine-2-carboxamide?
The InChIKey is QJJHYZGTNBYEMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O3/c1-12-11(16)9-4-3-6-14(9)10(15)8-13-5-7-17-2/h9,13H,3-8H2,1-2H3,(H,12,16).
What are the key properties of 1-[2-(2-methoxyethylamino)acetyl]-N-methylpyrrolidine-2-carboxamide?
1-[2-(2-methoxyethylamino)acetyl]-N-methylpyrrolidine-2-carboxamide has a molecular weight of 243.31 g/mol, XLogP of -1.04, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2-methoxyethylamino)acetyl]-N-methylpyrrolidine-2-carboxamide is sourced from PubChem (CID 79282787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).