1-(2-ethylmorpholine-4-carbonyl)-3-methylpiperidine-2-carboxylic acid

C14H24N2O4 — CID 107071345

IUPAC1-(2-ethylmorpholine-4-carbonyl)-3-methylpiperidine-2-carboxylic acid
SMILESCCC1CN(C(=O)N2CCCC(C)C2C(=O)O)CCO1
InChIInChI=1S/C14H24N2O4/c1-3-11-9-15(7-8-20-11)14(19)16-6-4-5-10(2)12(16)13(17)18/h10-12H,3-9H2,1-2H3,(H,17,18)
InChIKeyCYOVRLUEONNHBD-UHFFFAOYSA-N
MW284.36 g/mol
LogP1.40
Rot. Bonds2

About 1-(2-ethylmorpholine-4-carbonyl)-3-methylpiperidine-2-carboxylic acid

1-(2-ethylmorpholine-4-carbonyl)-3-methylpiperidine-2-carboxylic acid (PubChem CID 107071345) has the molecular formula C14H24N2O4 and a molecular weight of 284.36 g/mol. Its IUPAC name is 1-(2-ethylmorpholine-4-carbonyl)-3-methylpiperidine-2-carboxylic acid.

Molecular Properties

Compound Name1-(2-ethylmorpholine-4-carbonyl)-3-methylpiperidine-2-carboxylic acid
PubChem CID107071345
Molecular FormulaC14H24N2O4
Molecular Weight284.36 g/mol
Exact Mass284.17
IUPAC Name1-(2-ethylmorpholine-4-carbonyl)-3-methylpiperidine-2-carboxylic acid
SMILESCCC1CN(C(=O)N2CCCC(C)C2C(=O)O)CCO1
InChIInChI=1S/C14H24N2O4/c1-3-11-9-15(7-8-20-11)14(19)16-6-4-5-10(2)12(16)13(17)18/h10-12H,3-9H2,1-2H3,(H,17,18)
InChIKeyCYOVRLUEONNHBD-UHFFFAOYSA-N
XLogP1.40
TPSA70.08 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[2-(hydroxymethyl)morpholine-4-carbonyl]-3-methylpiperidine-2-carboxylic acid
CID 107071792
1-(3-ethylpiperidine-1-carbonyl)-3-methylpiperidine-2-carboxylic acid
CID 107071356
1-(2-cyanomorpholine-4-carbonyl)-3-methylpiperidine-2-carboxylic acid
CID 107071765
2-[4-(2,3-dimethylpiperidine-1-carbonyl)morpholin-2-yl]acetic acid
CID 66434882
2-(2-ethylmorpholine-4-carbonyl)cyclohexane-1-carboxylic acid
CID 43562559
1-(3-methoxycarbonylpyrrolidine-1-carbonyl)-3-methylpiperidine-2-carboxylic acid
CID 107071779
(2S)-1-(2-ethylmorpholine-4-carbonyl)-4-hydroxypyrrolidine-2-carboxylic acid
CID 61200786
(2S)-1-[2-(2-methoxy-2-oxoethyl)morpholine-4-carbonyl]pyrrolidine-2-carboxylic acid
CID 115535473
2-ethylmorpholine-4-carboxylic acid
CID 121455686
1-(4,4-dimethylazepane-1-carbonyl)-3-methylpiperidine-2-carboxylic acid
CID 107071729
3-methyl-1-(morpholine-4-carbonyl)pyrrolidine-2-carboxylic acid
CID 104937291
6-(2-ethylmorpholine-4-carbonyl)cyclohex-3-ene-1-carboxylic acid
CID 43562560

Frequently Asked Questions

What is the IUPAC name of 1-(2-ethylmorpholine-4-carbonyl)-3-methylpiperidine-2-carboxylic acid?
The IUPAC name of 1-(2-ethylmorpholine-4-carbonyl)-3-methylpiperidine-2-carboxylic acid (CID 107071345) is 1-(2-ethylmorpholine-4-carbonyl)-3-methylpiperidine-2-carboxylic acid.
What is the SMILES notation for 1-(2-ethylmorpholine-4-carbonyl)-3-methylpiperidine-2-carboxylic acid?
The canonical SMILES for 1-(2-ethylmorpholine-4-carbonyl)-3-methylpiperidine-2-carboxylic acid is CCC1CN(C(=O)N2CCCC(C)C2C(=O)O)CCO1.
What is the InChIKey of 1-(2-ethylmorpholine-4-carbonyl)-3-methylpiperidine-2-carboxylic acid?
The InChIKey is CYOVRLUEONNHBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O4/c1-3-11-9-15(7-8-20-11)14(19)16-6-4-5-10(2)12(16)13(17)18/h10-12H,3-9H2,1-2H3,(H,17,18).
What are the key properties of 1-(2-ethylmorpholine-4-carbonyl)-3-methylpiperidine-2-carboxylic acid?
1-(2-ethylmorpholine-4-carbonyl)-3-methylpiperidine-2-carboxylic acid has a molecular weight of 284.36 g/mol, XLogP of 1.40, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethylmorpholine-4-carbonyl)-3-methylpiperidine-2-carboxylic acid is sourced from PubChem (CID 107071345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).