3-(2-methoxyethyl)-1-(morpholine-4-carbonyl)piperidine-3-carboxylic acid

C14H24N2O5 — CID 72931993

IUPAC3-(2-methoxyethyl)-1-(morpholine-4-carbonyl)piperidine-3-carboxylic acid
SMILESCOCCC1(C(=O)O)CCCN(C(=O)N2CCOCC2)C1
InChIInChI=1S/C14H24N2O5/c1-20-8-4-14(12(17)18)3-2-5-16(11-14)13(19)15-6-9-21-10-7-15/h2-11H2,1H3,(H,17,18)
InChIKeyTUZYLOMHYKMQPV-UHFFFAOYSA-N
MW300.36 g/mol
LogP0.64
Rot. Bonds4

About 3-(2-methoxyethyl)-1-(morpholine-4-carbonyl)piperidine-3-carboxylic acid

3-(2-methoxyethyl)-1-(morpholine-4-carbonyl)piperidine-3-carboxylic acid (PubChem CID 72931993) has the molecular formula C14H24N2O5 and a molecular weight of 300.36 g/mol. Its IUPAC name is 3-(2-methoxyethyl)-1-(morpholine-4-carbonyl)piperidine-3-carboxylic acid.

Molecular Properties

Compound Name3-(2-methoxyethyl)-1-(morpholine-4-carbonyl)piperidine-3-carboxylic acid
PubChem CID72931993
Molecular FormulaC14H24N2O5
Molecular Weight300.36 g/mol
Exact Mass300.17
IUPAC Name3-(2-methoxyethyl)-1-(morpholine-4-carbonyl)piperidine-3-carboxylic acid
SMILESCOCCC1(C(=O)O)CCCN(C(=O)N2CCOCC2)C1
InChIInChI=1S/C14H24N2O5/c1-20-8-4-14(12(17)18)3-2-5-16(11-14)13(19)15-6-9-21-10-7-15/h2-11H2,1H3,(H,17,18)
InChIKeyTUZYLOMHYKMQPV-UHFFFAOYSA-N
XLogP0.64
TPSA79.31 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.36
LogP ≤ 50.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(2-methoxyethyl)-1-(morpholine-4-carbonyl)piperidine-3-carboxylic acid?
The IUPAC name of 3-(2-methoxyethyl)-1-(morpholine-4-carbonyl)piperidine-3-carboxylic acid (CID 72931993) is 3-(2-methoxyethyl)-1-(morpholine-4-carbonyl)piperidine-3-carboxylic acid.
What is the SMILES notation for 3-(2-methoxyethyl)-1-(morpholine-4-carbonyl)piperidine-3-carboxylic acid?
The canonical SMILES for 3-(2-methoxyethyl)-1-(morpholine-4-carbonyl)piperidine-3-carboxylic acid is COCCC1(C(=O)O)CCCN(C(=O)N2CCOCC2)C1.
What is the InChIKey of 3-(2-methoxyethyl)-1-(morpholine-4-carbonyl)piperidine-3-carboxylic acid?
The InChIKey is TUZYLOMHYKMQPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O5/c1-20-8-4-14(12(17)18)3-2-5-16(11-14)13(19)15-6-9-21-10-7-15/h2-11H2,1H3,(H,17,18).
What are the key properties of 3-(2-methoxyethyl)-1-(morpholine-4-carbonyl)piperidine-3-carboxylic acid?
3-(2-methoxyethyl)-1-(morpholine-4-carbonyl)piperidine-3-carboxylic acid has a molecular weight of 300.36 g/mol, XLogP of 0.64, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methoxyethyl)-1-(morpholine-4-carbonyl)piperidine-3-carboxylic acid is sourced from PubChem (CID 72931993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).