1-(4-aminooxolane-3-carbonyl)-N,N-dimethylpyrrolidine-2-carboxamide

C12H21N3O3 — CID 66240806

IUPAC1-(4-aminooxolane-3-carbonyl)-N,N-dimethylpyrrolidine-2-carboxamide
SMILESCN(C)C(=O)C1CCCN1C(=O)C1COCC1N
InChIInChI=1S/C12H21N3O3/c1-14(2)12(17)10-4-3-5-15(10)11(16)8-6-18-7-9(8)13/h8-10H,3-7,13H2,1-2H3
InChIKeyWAPSRJYXZHEBBG-UHFFFAOYSA-N
MW255.32 g/mol
LogP-0.96
Rot. Bonds2

About 1-(4-aminooxolane-3-carbonyl)-N,N-dimethylpyrrolidine-2-carboxamide

1-(4-aminooxolane-3-carbonyl)-N,N-dimethylpyrrolidine-2-carboxamide (PubChem CID 66240806) has the molecular formula C12H21N3O3 and a molecular weight of 255.32 g/mol. Its IUPAC name is 1-(4-aminooxolane-3-carbonyl)-N,N-dimethylpyrrolidine-2-carboxamide.

Molecular Properties

Compound Name1-(4-aminooxolane-3-carbonyl)-N,N-dimethylpyrrolidine-2-carboxamide
PubChem CID66240806
Molecular FormulaC12H21N3O3
Molecular Weight255.32 g/mol
Exact Mass255.16
IUPAC Name1-(4-aminooxolane-3-carbonyl)-N,N-dimethylpyrrolidine-2-carboxamide
SMILESCN(C)C(=O)C1CCCN1C(=O)C1COCC1N
InChIInChI=1S/C12H21N3O3/c1-14(2)12(17)10-4-3-5-15(10)11(16)8-6-18-7-9(8)13/h8-10H,3-7,13H2,1-2H3
InChIKeyWAPSRJYXZHEBBG-UHFFFAOYSA-N
XLogP-0.96
TPSA75.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 5-0.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(4-aminooxolan-3-yl)-(2-methylpyrrolidin-1-yl)methanone
CID 66236454
1-(cyclopropanecarbonyl)-N,N-dimethylpyrrolidine-2-carboxamide
CID 60717815
(4-aminooxolan-3-yl)-(2-cyclohexylpyrrolidin-1-yl)methanone
CID 66237049
(2S)-1-[(2S)-1-[(2S)-1-acetylpyrrolidine-2-carbonyl]pyrrolidine-2-carbonyl]-N,N-dimethylpyrrolidine-2-carboxamide
CID 101411336
2-(dimethylcarbamoyl)pyrrolidine-1-carboxylic acid
CID 89401620
ethyl 2-(dimethylcarbamoyl)pyrrolidine-1-carboxylate
CID 60700666
(2R,5S)-5-[2-(dimethylcarbamoyl)pyrrolidine-1-carbonyl]oxolane-2-carboxylic acid
CID 102944442
(4-aminooxolan-3-yl)-(3-methylpiperidin-1-yl)methanone
CID 66239793
1-[4-(methylamino)oxolane-3-carbonyl]pyrrolidine-2-carboxylic acid
CID 66267016
N,N-dimethyl-1-(pyrrolidine-2-carbonyl)pyrrolidine-2-carboxamide
CID 43579479
1-(2,2-dimethylpropanoyl)-N,N-dimethylpyrrolidine-2-carboxamide
CID 60858063
(4-aminooxolan-3-yl)-[2-(3-methyl-1,2-oxazol-5-yl)pyrrolidin-1-yl]methanone
CID 66236852

Frequently Asked Questions

What is the IUPAC name of 1-(4-aminooxolane-3-carbonyl)-N,N-dimethylpyrrolidine-2-carboxamide?
The IUPAC name of 1-(4-aminooxolane-3-carbonyl)-N,N-dimethylpyrrolidine-2-carboxamide (CID 66240806) is 1-(4-aminooxolane-3-carbonyl)-N,N-dimethylpyrrolidine-2-carboxamide.
What is the SMILES notation for 1-(4-aminooxolane-3-carbonyl)-N,N-dimethylpyrrolidine-2-carboxamide?
The canonical SMILES for 1-(4-aminooxolane-3-carbonyl)-N,N-dimethylpyrrolidine-2-carboxamide is CN(C)C(=O)C1CCCN1C(=O)C1COCC1N.
What is the InChIKey of 1-(4-aminooxolane-3-carbonyl)-N,N-dimethylpyrrolidine-2-carboxamide?
The InChIKey is WAPSRJYXZHEBBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3O3/c1-14(2)12(17)10-4-3-5-15(10)11(16)8-6-18-7-9(8)13/h8-10H,3-7,13H2,1-2H3.
What are the key properties of 1-(4-aminooxolane-3-carbonyl)-N,N-dimethylpyrrolidine-2-carboxamide?
1-(4-aminooxolane-3-carbonyl)-N,N-dimethylpyrrolidine-2-carboxamide has a molecular weight of 255.32 g/mol, XLogP of -0.96, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-aminooxolane-3-carbonyl)-N,N-dimethylpyrrolidine-2-carboxamide is sourced from PubChem (CID 66240806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).