1-(2,2,6,6-tetramethylmorpholine-4-carbonyl)pyrrolidine-3-carboxylic acid

C14H24N2O4 — CID 102744970

IUPAC1-(2,2,6,6-tetramethylmorpholine-4-carbonyl)pyrrolidine-3-carboxylic acid
SMILESCC1(C)CN(C(=O)N2CCC(C(=O)O)C2)CC(C)(C)O1
InChIInChI=1S/C14H24N2O4/c1-13(2)8-16(9-14(3,4)20-13)12(19)15-6-5-10(7-15)11(17)18/h10H,5-9H2,1-4H3,(H,17,18)
InChIKeyLDSSSEBKZVPHIK-UHFFFAOYSA-N
MW284.36 g/mol
LogP1.40
Rot. Bonds1

About 1-(2,2,6,6-tetramethylmorpholine-4-carbonyl)pyrrolidine-3-carboxylic acid

1-(2,2,6,6-tetramethylmorpholine-4-carbonyl)pyrrolidine-3-carboxylic acid (PubChem CID 102744970) has the molecular formula C14H24N2O4 and a molecular weight of 284.36 g/mol. Its IUPAC name is 1-(2,2,6,6-tetramethylmorpholine-4-carbonyl)pyrrolidine-3-carboxylic acid.

Molecular Properties

Compound Name1-(2,2,6,6-tetramethylmorpholine-4-carbonyl)pyrrolidine-3-carboxylic acid
PubChem CID102744970
Molecular FormulaC14H24N2O4
Molecular Weight284.36 g/mol
Exact Mass284.17
IUPAC Name1-(2,2,6,6-tetramethylmorpholine-4-carbonyl)pyrrolidine-3-carboxylic acid
SMILESCC1(C)CN(C(=O)N2CCC(C(=O)O)C2)CC(C)(C)O1
InChIInChI=1S/C14H24N2O4/c1-13(2)8-16(9-14(3,4)20-13)12(19)15-6-5-10(7-15)11(17)18/h10H,5-9H2,1-4H3,(H,17,18)
InChIKeyLDSSSEBKZVPHIK-UHFFFAOYSA-N
XLogP1.40
TPSA70.08 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2,2,6,6-tetramethylmorpholine-4-carbonyl)piperidine-4-carboxylic acid
CID 102744940
1-(4,4-dimethylpiperidine-1-carbonyl)pyrrolidine-3-carboxylic acid
CID 63032464
azepan-1-yl-(2,2,6,6-tetramethylmorpholin-4-yl)methanone
CID 102743359
4-methyl-1-(2,2,6,6-tetramethylmorpholine-4-carbonyl)pyrrolidine-3-carboxylic acid
CID 102744923
1-(3-carbamoylpyrrolidine-1-carbonyl)pyrrolidine-3-carboxylic acid
CID 114082318
1-(2,2,6,6-tetramethylmorpholine-4-carbonyl)piperidine-2-carboxylic acid
CID 102744917
pyrrolidine-1,3-dicarboxylic acid
CID 22258620
1-(4-propylpiperidine-1-carbonyl)pyrrolidine-3-carboxylic acid
CID 55151760
1-(3,3,4-trimethylpiperazine-1-carbonyl)piperidine-4-carboxylic acid
CID 63614384
1-(4-methyl-1,4-diazepane-1-carbonyl)pyrrolidine-3-carboxylic acid
CID 63030858
1-(3-morpholin-4-ylpyrrolidine-1-carbonyl)pyrrolidine-3-carboxylic acid
CID 63550050
(2S,4R)-4-hydroxy-1-(2,2,6,6-tetramethylmorpholine-4-carbonyl)pyrrolidine-2-carboxylic acid
CID 102744949

Frequently Asked Questions

What is the IUPAC name of 1-(2,2,6,6-tetramethylmorpholine-4-carbonyl)pyrrolidine-3-carboxylic acid?
The IUPAC name of 1-(2,2,6,6-tetramethylmorpholine-4-carbonyl)pyrrolidine-3-carboxylic acid (CID 102744970) is 1-(2,2,6,6-tetramethylmorpholine-4-carbonyl)pyrrolidine-3-carboxylic acid.
What is the SMILES notation for 1-(2,2,6,6-tetramethylmorpholine-4-carbonyl)pyrrolidine-3-carboxylic acid?
The canonical SMILES for 1-(2,2,6,6-tetramethylmorpholine-4-carbonyl)pyrrolidine-3-carboxylic acid is CC1(C)CN(C(=O)N2CCC(C(=O)O)C2)CC(C)(C)O1.
What is the InChIKey of 1-(2,2,6,6-tetramethylmorpholine-4-carbonyl)pyrrolidine-3-carboxylic acid?
The InChIKey is LDSSSEBKZVPHIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O4/c1-13(2)8-16(9-14(3,4)20-13)12(19)15-6-5-10(7-15)11(17)18/h10H,5-9H2,1-4H3,(H,17,18).
What are the key properties of 1-(2,2,6,6-tetramethylmorpholine-4-carbonyl)pyrrolidine-3-carboxylic acid?
1-(2,2,6,6-tetramethylmorpholine-4-carbonyl)pyrrolidine-3-carboxylic acid has a molecular weight of 284.36 g/mol, XLogP of 1.40, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,2,6,6-tetramethylmorpholine-4-carbonyl)pyrrolidine-3-carboxylic acid is sourced from PubChem (CID 102744970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).