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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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).