4-ethyl-1-(2-morpholin-3-ylacetyl)piperidine-2-carboxylic acid

C14H24N2O4 — CID 114429784

IUPAC4-ethyl-1-(2-morpholin-3-ylacetyl)piperidine-2-carboxylic acid
SMILESCCC1CCN(C(=O)CC2COCCN2)C(C(=O)O)C1
InChIInChI=1S/C14H24N2O4/c1-2-10-3-5-16(12(7-10)14(18)19)13(17)8-11-9-20-6-4-15-11/h10-12,15H,2-9H2,1H3,(H,18,19)
InChIKeyRDQQNGUFDYILSH-UHFFFAOYSA-N
MW284.36 g/mol
LogP0.47
Rot. Bonds4

About 4-ethyl-1-(2-morpholin-3-ylacetyl)piperidine-2-carboxylic acid

4-ethyl-1-(2-morpholin-3-ylacetyl)piperidine-2-carboxylic acid (PubChem CID 114429784) has the molecular formula C14H24N2O4 and a molecular weight of 284.36 g/mol. Its IUPAC name is 4-ethyl-1-(2-morpholin-3-ylacetyl)piperidine-2-carboxylic acid.

Molecular Properties

Compound Name4-ethyl-1-(2-morpholin-3-ylacetyl)piperidine-2-carboxylic acid
PubChem CID114429784
Molecular FormulaC14H24N2O4
Molecular Weight284.36 g/mol
Exact Mass284.17
IUPAC Name4-ethyl-1-(2-morpholin-3-ylacetyl)piperidine-2-carboxylic acid
SMILESCCC1CCN(C(=O)CC2COCCN2)C(C(=O)O)C1
InChIInChI=1S/C14H24N2O4/c1-2-10-3-5-16(12(7-10)14(18)19)13(17)8-11-9-20-6-4-15-11/h10-12,15H,2-9H2,1H3,(H,18,19)
InChIKeyRDQQNGUFDYILSH-UHFFFAOYSA-N
XLogP0.47
TPSA78.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 50.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-ethyl-1-(2-pyrrolidin-2-ylacetyl)piperidine-2-carboxylic acid
CID 114429627
4-ethyl-1-(2-thiomorpholin-3-ylacetyl)piperidine-2-carboxylic acid
CID 114429640
4-(2-morpholin-3-ylacetyl)thiomorpholine-3-carboxylic acid
CID 82904512
1-butanoyl-4-ethylpiperidine-2-carboxylic acid
CID 114426953
1-[(3R)-3-methylmorpholin-4-yl]-2-morpholin-3-ylethanone
CID 106774293
1-(2-ethoxyacetyl)-4-ethylpiperidine-2-carboxylic acid
CID 114426976
N-methyl-4-(2-morpholin-3-ylacetyl)morpholine-3-carboxamide
CID 83099010
4-ethyl-1-[2-(propylamino)acetyl]piperidine-2-carboxylic acid
CID 114429674
4-ethyl-1-(2-methylsulfonylacetyl)piperidine-2-carboxylic acid
CID 114427207
4-ethyl-1-(3-methylsulfanylpropanoyl)piperidine-2-carboxylic acid
CID 114427038
1-(cyclopropylcarbamoyl)-4-ethylpiperidine-2-carboxylic acid
CID 114427375
4-ethyl-1-(3-propoxypropanoyl)piperidine-2-carboxylic acid
CID 114427347

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-1-(2-morpholin-3-ylacetyl)piperidine-2-carboxylic acid?
The IUPAC name of 4-ethyl-1-(2-morpholin-3-ylacetyl)piperidine-2-carboxylic acid (CID 114429784) is 4-ethyl-1-(2-morpholin-3-ylacetyl)piperidine-2-carboxylic acid.
What is the SMILES notation for 4-ethyl-1-(2-morpholin-3-ylacetyl)piperidine-2-carboxylic acid?
The canonical SMILES for 4-ethyl-1-(2-morpholin-3-ylacetyl)piperidine-2-carboxylic acid is CCC1CCN(C(=O)CC2COCCN2)C(C(=O)O)C1.
What is the InChIKey of 4-ethyl-1-(2-morpholin-3-ylacetyl)piperidine-2-carboxylic acid?
The InChIKey is RDQQNGUFDYILSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O4/c1-2-10-3-5-16(12(7-10)14(18)19)13(17)8-11-9-20-6-4-15-11/h10-12,15H,2-9H2,1H3,(H,18,19).
What are the key properties of 4-ethyl-1-(2-morpholin-3-ylacetyl)piperidine-2-carboxylic acid?
4-ethyl-1-(2-morpholin-3-ylacetyl)piperidine-2-carboxylic acid has a molecular weight of 284.36 g/mol, XLogP of 0.47, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-1-(2-morpholin-3-ylacetyl)piperidine-2-carboxylic acid is sourced from PubChem (CID 114429784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).