1-(3,3-dimethylmorpholine-4-carbonyl)-4-methylpiperidine-4-carboxylic acid

C14H24N2O4 — CID 63124235

IUPAC1-(3,3-dimethylmorpholine-4-carbonyl)-4-methylpiperidine-4-carboxylic acid
SMILESCC1(C(=O)O)CCN(C(=O)N2CCOCC2(C)C)CC1
InChIInChI=1S/C14H24N2O4/c1-13(2)10-20-9-8-16(13)12(19)15-6-4-14(3,5-7-15)11(17)18/h4-10H2,1-3H3,(H,17,18)
InChIKeyIAZKMRREHIHPBJ-UHFFFAOYSA-N
MW284.36 g/mol
LogP1.40
Rot. Bonds1

About 1-(3,3-dimethylmorpholine-4-carbonyl)-4-methylpiperidine-4-carboxylic acid

1-(3,3-dimethylmorpholine-4-carbonyl)-4-methylpiperidine-4-carboxylic acid (PubChem CID 63124235) has the molecular formula C14H24N2O4 and a molecular weight of 284.36 g/mol. Its IUPAC name is 1-(3,3-dimethylmorpholine-4-carbonyl)-4-methylpiperidine-4-carboxylic acid.

Molecular Properties

Compound Name1-(3,3-dimethylmorpholine-4-carbonyl)-4-methylpiperidine-4-carboxylic acid
PubChem CID63124235
Molecular FormulaC14H24N2O4
Molecular Weight284.36 g/mol
Exact Mass284.17
IUPAC Name1-(3,3-dimethylmorpholine-4-carbonyl)-4-methylpiperidine-4-carboxylic acid
SMILESCC1(C(=O)O)CCN(C(=O)N2CCOCC2(C)C)CC1
InChIInChI=1S/C14H24N2O4/c1-13(2)10-20-9-8-16(13)12(19)15-6-4-14(3,5-7-15)11(17)18/h4-10H2,1-3H3,(H,17,18)
InChIKeyIAZKMRREHIHPBJ-UHFFFAOYSA-N
XLogP1.40
TPSA70.08 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
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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Frequently Asked Questions

What is the IUPAC name of 1-(3,3-dimethylmorpholine-4-carbonyl)-4-methylpiperidine-4-carboxylic acid?
The IUPAC name of 1-(3,3-dimethylmorpholine-4-carbonyl)-4-methylpiperidine-4-carboxylic acid (CID 63124235) is 1-(3,3-dimethylmorpholine-4-carbonyl)-4-methylpiperidine-4-carboxylic acid.
What is the SMILES notation for 1-(3,3-dimethylmorpholine-4-carbonyl)-4-methylpiperidine-4-carboxylic acid?
The canonical SMILES for 1-(3,3-dimethylmorpholine-4-carbonyl)-4-methylpiperidine-4-carboxylic acid is CC1(C(=O)O)CCN(C(=O)N2CCOCC2(C)C)CC1.
What is the InChIKey of 1-(3,3-dimethylmorpholine-4-carbonyl)-4-methylpiperidine-4-carboxylic acid?
The InChIKey is IAZKMRREHIHPBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O4/c1-13(2)10-20-9-8-16(13)12(19)15-6-4-14(3,5-7-15)11(17)18/h4-10H2,1-3H3,(H,17,18).
What are the key properties of 1-(3,3-dimethylmorpholine-4-carbonyl)-4-methylpiperidine-4-carboxylic acid?
1-(3,3-dimethylmorpholine-4-carbonyl)-4-methylpiperidine-4-carboxylic acid has a molecular weight of 284.36 g/mol, XLogP of 1.40, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,3-dimethylmorpholine-4-carbonyl)-4-methylpiperidine-4-carboxylic acid is sourced from PubChem (CID 63124235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).