4-ethyl-1-(morpholine-4-carbonyl)piperidine-4-carboxylic acid

C13H22N2O4 — CID 63126334

IUPAC4-ethyl-1-(morpholine-4-carbonyl)piperidine-4-carboxylic acid
SMILESCCC1(C(=O)O)CCN(C(=O)N2CCOCC2)CC1
InChIInChI=1S/C13H22N2O4/c1-2-13(11(16)17)3-5-14(6-4-13)12(18)15-7-9-19-10-8-15/h2-10H2,1H3,(H,16,17)
InChIKeyOLTSDXSUUGLMTN-UHFFFAOYSA-N
MW270.33 g/mol
LogP1.02
Rot. Bonds2

About 4-ethyl-1-(morpholine-4-carbonyl)piperidine-4-carboxylic acid

4-ethyl-1-(morpholine-4-carbonyl)piperidine-4-carboxylic acid (PubChem CID 63126334) has the molecular formula C13H22N2O4 and a molecular weight of 270.33 g/mol. Its IUPAC name is 4-ethyl-1-(morpholine-4-carbonyl)piperidine-4-carboxylic acid.

Molecular Properties

Compound Name4-ethyl-1-(morpholine-4-carbonyl)piperidine-4-carboxylic acid
PubChem CID63126334
Molecular FormulaC13H22N2O4
Molecular Weight270.33 g/mol
Exact Mass270.16
IUPAC Name4-ethyl-1-(morpholine-4-carbonyl)piperidine-4-carboxylic acid
SMILESCCC1(C(=O)O)CCN(C(=O)N2CCOCC2)CC1
InChIInChI=1S/C13H22N2O4/c1-2-13(11(16)17)3-5-14(6-4-13)12(18)15-7-9-19-10-8-15/h2-10H2,1H3,(H,16,17)
InChIKeyOLTSDXSUUGLMTN-UHFFFAOYSA-N
XLogP1.02
TPSA70.08 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.33
LogP ≤ 51.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-ethyl-1-(1,4-oxazepane-4-carbonyl)piperidine-4-carboxylic acid
CID 63127462
1-(3,3-dimethylmorpholine-4-carbonyl)-4-ethylpiperidine-4-carboxylic acid
CID 63127056
3-ethyl-1-(thiomorpholine-4-carbonyl)pyrrolidine-3-carboxylic acid
CID 63146066
3-ethyl-1-(2-methylmorpholine-4-carbonyl)pyrrolidine-3-carboxylic acid
CID 63145950
1-[3-(dimethylamino)pyrrolidine-1-carbonyl]-4-ethylpiperidine-4-carboxylic acid
CID 63548476
4-ethylazepane-1,4-dicarboxylic acid
CID 123426716
4-propyl-1-(pyrrolidine-1-carbonyl)piperidine-4-carboxylic acid
CID 63126397
1-[3-(aminomethyl)pyrrolidine-1-carbonyl]-4-ethylpiperidine-4-carboxylic acid
CID 63127514
3-ethyl-1-[2-(hydroxymethyl)morpholine-4-carbonyl]pyrrolidine-3-carboxylic acid
CID 81204424
3-ethyl-1-[4-(2-hydroxyethyl)piperazine-1-carbonyl]pyrrolidine-3-carboxylic acid
CID 63149236
1-(1-morpholin-4-yl-1-oxopropan-2-yl)-3-propylpyrrolidine-3-carboxylic acid
CID 63148630
1-(2,2-dimethylmorpholine-4-carbonyl)-3-propylpyrrolidine-3-carboxylic acid
CID 63149279

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-1-(morpholine-4-carbonyl)piperidine-4-carboxylic acid?
The IUPAC name of 4-ethyl-1-(morpholine-4-carbonyl)piperidine-4-carboxylic acid (CID 63126334) is 4-ethyl-1-(morpholine-4-carbonyl)piperidine-4-carboxylic acid.
What is the SMILES notation for 4-ethyl-1-(morpholine-4-carbonyl)piperidine-4-carboxylic acid?
The canonical SMILES for 4-ethyl-1-(morpholine-4-carbonyl)piperidine-4-carboxylic acid is CCC1(C(=O)O)CCN(C(=O)N2CCOCC2)CC1.
What is the InChIKey of 4-ethyl-1-(morpholine-4-carbonyl)piperidine-4-carboxylic acid?
The InChIKey is OLTSDXSUUGLMTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O4/c1-2-13(11(16)17)3-5-14(6-4-13)12(18)15-7-9-19-10-8-15/h2-10H2,1H3,(H,16,17).
What are the key properties of 4-ethyl-1-(morpholine-4-carbonyl)piperidine-4-carboxylic acid?
4-ethyl-1-(morpholine-4-carbonyl)piperidine-4-carboxylic acid has a molecular weight of 270.33 g/mol, XLogP of 1.02, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-1-(morpholine-4-carbonyl)piperidine-4-carboxylic acid is sourced from PubChem (CID 63126334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).