1-(5-ethyl-2-methylmorpholine-4-carbonyl)-4-methylpiperidine-2-carboxylic acid

C15H26N2O4 — CID 114425340

IUPAC1-(5-ethyl-2-methylmorpholine-4-carbonyl)-4-methylpiperidine-2-carboxylic acid
SMILESCCC1COC(C)CN1C(=O)N1CCC(C)CC1C(=O)O
InChIInChI=1S/C15H26N2O4/c1-4-12-9-21-11(3)8-17(12)15(20)16-6-5-10(2)7-13(16)14(18)19/h10-13H,4-9H2,1-3H3,(H,18,19)
InChIKeyGDIWLSSPKWBFQU-UHFFFAOYSA-N
MW298.38 g/mol
LogP1.79
Rot. Bonds2

About 1-(5-ethyl-2-methylmorpholine-4-carbonyl)-4-methylpiperidine-2-carboxylic acid

1-(5-ethyl-2-methylmorpholine-4-carbonyl)-4-methylpiperidine-2-carboxylic acid (PubChem CID 114425340) has the molecular formula C15H26N2O4 and a molecular weight of 298.38 g/mol. Its IUPAC name is 1-(5-ethyl-2-methylmorpholine-4-carbonyl)-4-methylpiperidine-2-carboxylic acid.

Molecular Properties

Compound Name1-(5-ethyl-2-methylmorpholine-4-carbonyl)-4-methylpiperidine-2-carboxylic acid
PubChem CID114425340
Molecular FormulaC15H26N2O4
Molecular Weight298.38 g/mol
Exact Mass298.19
IUPAC Name1-(5-ethyl-2-methylmorpholine-4-carbonyl)-4-methylpiperidine-2-carboxylic acid
SMILESCCC1COC(C)CN1C(=O)N1CCC(C)CC1C(=O)O
InChIInChI=1S/C15H26N2O4/c1-4-12-9-21-11(3)8-17(12)15(20)16-6-5-10(2)7-13(16)14(18)19/h10-13H,4-9H2,1-3H3,(H,18,19)
InChIKeyGDIWLSSPKWBFQU-UHFFFAOYSA-N
XLogP1.79
TPSA70.08 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.38
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(5-ethyl-2-methylmorpholine-4-carbonyl)-2-methylpyrrolidine-3-carboxylic acid
CID 79382717
1-(5-ethyl-2-methylmorpholine-4-carbonyl)-4-methoxypyrrolidine-2-carboxylic acid
CID 61424652
1-(2-ethylpiperidine-1-carbonyl)-4-methylpiperidine-2-carboxylic acid
CID 114425231
3-(5-ethyl-2-methylmorpholine-4-carbonyl)-2-methyl-1,3-thiazolidine-4-carboxylic acid
CID 63779868
(3S)-1-(5-ethyl-2-methylmorpholine-4-carbonyl)piperidine-3-carboxylic acid
CID 81126016
(5-ethyl-2-methylmorpholin-4-yl)-piperidin-1-ylmethanone
CID 113222014
cyclopropyl-(5-ethyl-2-methylmorpholin-4-yl)methanone
CID 60645279
1-(2,4-dimethylpiperidine-1-carbonyl)-4-ethylpiperidine-2-carboxylic acid
CID 114430350
3-(5-ethyl-2-methylmorpholine-4-carbonyl)bicyclo[2.2.1]hept-5-ene-2-carboxylic acid
CID 43578295
(5-ethyl-2-methylmorpholin-4-yl)-(4-methylpiperidin-2-yl)methanone
CID 114422854
4-methyl-1-(8-oxa-3-azabicyclo[3.2.1]octane-3-carbonyl)piperidine-2-carboxylic acid
CID 114425695
1-(2-azabicyclo[2.2.1]heptane-2-carbonyl)-4-methylpiperidine-2-carboxylic acid
CID 114425408

Frequently Asked Questions

What is the IUPAC name of 1-(5-ethyl-2-methylmorpholine-4-carbonyl)-4-methylpiperidine-2-carboxylic acid?
The IUPAC name of 1-(5-ethyl-2-methylmorpholine-4-carbonyl)-4-methylpiperidine-2-carboxylic acid (CID 114425340) is 1-(5-ethyl-2-methylmorpholine-4-carbonyl)-4-methylpiperidine-2-carboxylic acid.
What is the SMILES notation for 1-(5-ethyl-2-methylmorpholine-4-carbonyl)-4-methylpiperidine-2-carboxylic acid?
The canonical SMILES for 1-(5-ethyl-2-methylmorpholine-4-carbonyl)-4-methylpiperidine-2-carboxylic acid is CCC1COC(C)CN1C(=O)N1CCC(C)CC1C(=O)O.
What is the InChIKey of 1-(5-ethyl-2-methylmorpholine-4-carbonyl)-4-methylpiperidine-2-carboxylic acid?
The InChIKey is GDIWLSSPKWBFQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O4/c1-4-12-9-21-11(3)8-17(12)15(20)16-6-5-10(2)7-13(16)14(18)19/h10-13H,4-9H2,1-3H3,(H,18,19).
What are the key properties of 1-(5-ethyl-2-methylmorpholine-4-carbonyl)-4-methylpiperidine-2-carboxylic acid?
1-(5-ethyl-2-methylmorpholine-4-carbonyl)-4-methylpiperidine-2-carboxylic acid has a molecular weight of 298.38 g/mol, XLogP of 1.79, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-ethyl-2-methylmorpholine-4-carbonyl)-4-methylpiperidine-2-carboxylic acid is sourced from PubChem (CID 114425340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).