5-oxo-4-(pyrrolidin-2-ylmethyl)morpholine-3-carboxylic acid

C10H16N2O4 — CID 115102725

IUPAC5-oxo-4-(pyrrolidin-2-ylmethyl)morpholine-3-carboxylic acid
SMILESO=C(O)C1COCC(=O)N1CC1CCCN1
InChIInChI=1S/C10H16N2O4/c13-9-6-16-5-8(10(14)15)12(9)4-7-2-1-3-11-7/h7-8,11H,1-6H2,(H,14,15)
InChIKeyUORVMUHVDNNIOB-UHFFFAOYSA-N
MW228.25 g/mol
LogP-0.95
Rot. Bonds3

About 5-oxo-4-(pyrrolidin-2-ylmethyl)morpholine-3-carboxylic acid

5-oxo-4-(pyrrolidin-2-ylmethyl)morpholine-3-carboxylic acid (PubChem CID 115102725) has the molecular formula C10H16N2O4 and a molecular weight of 228.25 g/mol. Its IUPAC name is 5-oxo-4-(pyrrolidin-2-ylmethyl)morpholine-3-carboxylic acid.

Molecular Properties

Compound Name5-oxo-4-(pyrrolidin-2-ylmethyl)morpholine-3-carboxylic acid
PubChem CID115102725
Molecular FormulaC10H16N2O4
Molecular Weight228.25 g/mol
Exact Mass228.11
IUPAC Name5-oxo-4-(pyrrolidin-2-ylmethyl)morpholine-3-carboxylic acid
SMILESO=C(O)C1COCC(=O)N1CC1CCCN1
InChIInChI=1S/C10H16N2O4/c13-9-6-16-5-8(10(14)15)12(9)4-7-2-1-3-11-7/h7-8,11H,1-6H2,(H,14,15)
InChIKeyUORVMUHVDNNIOB-UHFFFAOYSA-N
XLogP-0.95
TPSA78.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.25
LogP ≤ 5-0.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-[(1-methylpiperidin-4-yl)methyl]-5-oxomorpholine-3-carboxylic acid
CID 115102644
4-(pyrrolidin-2-ylmethyl)morpholine-3-carboxamide
CID 83096634
5-oxo-4-phosphanylmorpholine-3-carboxylic acid
CID 20828180
5-(hydroxymethyl)-4-pyrrolidin-2-ylmorpholin-3-one
CID 115102678
(3R)-4-benzyl-N-(2-methylpiperidin-3-yl)-5-oxomorpholine-3-carboxamide
CID 120577030
(3R)-4-benzyl-N-(2-methylpiperidin-3-yl)-5-oxomorpholine-3-carboxamide;hydrochloride
CID 120577029
2-oxo-3-pyrrolidin-2-yl-1,3-oxazolidine-4-carboxylic acid
CID 115102426
3-[[(2S)-piperidin-2-yl]methyl]-1,3-oxazolidine-2,4-dione
CID 99737469
1-(pyrrolidin-2-ylmethyl)pyrazolidin-3-one
CID 105434202
2-(pyrrolidin-2-ylmethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridine-5-carboxylic acid
CID 117154766
3-(piperidin-2-ylmethyl)-4,5,6,6a-tetrahydro-3aH-cyclopenta[d][1,3]oxazol-2-one
CID 105482162
1-(pyrrolidin-2-ylmethyl)azepan-4-one
CID 115020782

Frequently Asked Questions

What is the IUPAC name of 5-oxo-4-(pyrrolidin-2-ylmethyl)morpholine-3-carboxylic acid?
The IUPAC name of 5-oxo-4-(pyrrolidin-2-ylmethyl)morpholine-3-carboxylic acid (CID 115102725) is 5-oxo-4-(pyrrolidin-2-ylmethyl)morpholine-3-carboxylic acid.
What is the SMILES notation for 5-oxo-4-(pyrrolidin-2-ylmethyl)morpholine-3-carboxylic acid?
The canonical SMILES for 5-oxo-4-(pyrrolidin-2-ylmethyl)morpholine-3-carboxylic acid is O=C(O)C1COCC(=O)N1CC1CCCN1.
What is the InChIKey of 5-oxo-4-(pyrrolidin-2-ylmethyl)morpholine-3-carboxylic acid?
The InChIKey is UORVMUHVDNNIOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O4/c13-9-6-16-5-8(10(14)15)12(9)4-7-2-1-3-11-7/h7-8,11H,1-6H2,(H,14,15).
What are the key properties of 5-oxo-4-(pyrrolidin-2-ylmethyl)morpholine-3-carboxylic acid?
5-oxo-4-(pyrrolidin-2-ylmethyl)morpholine-3-carboxylic acid has a molecular weight of 228.25 g/mol, XLogP of -0.95, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-oxo-4-(pyrrolidin-2-ylmethyl)morpholine-3-carboxylic acid is sourced from PubChem (CID 115102725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).