4-(2-morpholin-4-yl-2-oxoethoxy)piperidine-1-carboxylic acid

C12H20N2O5 — CID 123694815

IUPAC4-(2-morpholin-4-yl-2-oxoethoxy)piperidine-1-carboxylic acid
SMILESO=C(O)N1CCC(OCC(=O)N2CCOCC2)CC1
InChIInChI=1S/C12H20N2O5/c15-11(13-5-7-18-8-6-13)9-19-10-1-3-14(4-2-10)12(16)17/h10H,1-9H2,(H,16,17)
InChIKeyZQIKIZSXZZPVDZ-UHFFFAOYSA-N
MW272.30 g/mol
LogP0.00
Rot. Bonds3

About 4-(2-morpholin-4-yl-2-oxoethoxy)piperidine-1-carboxylic acid

4-(2-morpholin-4-yl-2-oxoethoxy)piperidine-1-carboxylic acid (PubChem CID 123694815) has the molecular formula C12H20N2O5 and a molecular weight of 272.30 g/mol. Its IUPAC name is 4-(2-morpholin-4-yl-2-oxoethoxy)piperidine-1-carboxylic acid.

Molecular Properties

Compound Name4-(2-morpholin-4-yl-2-oxoethoxy)piperidine-1-carboxylic acid
PubChem CID123694815
Molecular FormulaC12H20N2O5
Molecular Weight272.30 g/mol
Exact Mass272.14
IUPAC Name4-(2-morpholin-4-yl-2-oxoethoxy)piperidine-1-carboxylic acid
SMILESO=C(O)N1CCC(OCC(=O)N2CCOCC2)CC1
InChIInChI=1S/C12H20N2O5/c15-11(13-5-7-18-8-6-13)9-19-10-1-3-14(4-2-10)12(16)17/h10H,1-9H2,(H,16,17)
InChIKeyZQIKIZSXZZPVDZ-UHFFFAOYSA-N
XLogP0.00
TPSA79.31 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.30
LogP ≤ 50.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(2-morpholin-4-yl-2-oxoethoxy)piperidine-1-carboxylic acid?
The IUPAC name of 4-(2-morpholin-4-yl-2-oxoethoxy)piperidine-1-carboxylic acid (CID 123694815) is 4-(2-morpholin-4-yl-2-oxoethoxy)piperidine-1-carboxylic acid.
What is the SMILES notation for 4-(2-morpholin-4-yl-2-oxoethoxy)piperidine-1-carboxylic acid?
The canonical SMILES for 4-(2-morpholin-4-yl-2-oxoethoxy)piperidine-1-carboxylic acid is O=C(O)N1CCC(OCC(=O)N2CCOCC2)CC1.
What is the InChIKey of 4-(2-morpholin-4-yl-2-oxoethoxy)piperidine-1-carboxylic acid?
The InChIKey is ZQIKIZSXZZPVDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O5/c15-11(13-5-7-18-8-6-13)9-19-10-1-3-14(4-2-10)12(16)17/h10H,1-9H2,(H,16,17).
What are the key properties of 4-(2-morpholin-4-yl-2-oxoethoxy)piperidine-1-carboxylic acid?
4-(2-morpholin-4-yl-2-oxoethoxy)piperidine-1-carboxylic acid has a molecular weight of 272.30 g/mol, XLogP of 0.00, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-morpholin-4-yl-2-oxoethoxy)piperidine-1-carboxylic acid is sourced from PubChem (CID 123694815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).