1-(2-morpholin-2-ylacetyl)-4-propylpiperidine-4-carboxylic acid

C15H26N2O4 — CID 66427689

IUPAC1-(2-morpholin-2-ylacetyl)-4-propylpiperidine-4-carboxylic acid
SMILESCCCC1(C(=O)O)CCN(C(=O)CC2CNCCO2)CC1
InChIInChI=1S/C15H26N2O4/c1-2-3-15(14(19)20)4-7-17(8-5-15)13(18)10-12-11-16-6-9-21-12/h12,16H,2-11H2,1H3,(H,19,20)
InChIKeyIWCDHQJJKNXLHV-UHFFFAOYSA-N
MW298.38 g/mol
LogP0.86
Rot. Bonds5

About 1-(2-morpholin-2-ylacetyl)-4-propylpiperidine-4-carboxylic acid

1-(2-morpholin-2-ylacetyl)-4-propylpiperidine-4-carboxylic acid (PubChem CID 66427689) has the molecular formula C15H26N2O4 and a molecular weight of 298.38 g/mol. Its IUPAC name is 1-(2-morpholin-2-ylacetyl)-4-propylpiperidine-4-carboxylic acid.

Molecular Properties

Compound Name1-(2-morpholin-2-ylacetyl)-4-propylpiperidine-4-carboxylic acid
PubChem CID66427689
Molecular FormulaC15H26N2O4
Molecular Weight298.38 g/mol
Exact Mass298.19
IUPAC Name1-(2-morpholin-2-ylacetyl)-4-propylpiperidine-4-carboxylic acid
SMILESCCCC1(C(=O)O)CCN(C(=O)CC2CNCCO2)CC1
InChIInChI=1S/C15H26N2O4/c1-2-3-15(14(19)20)4-7-17(8-5-15)13(18)10-12-11-16-6-9-21-12/h12,16H,2-11H2,1H3,(H,19,20)
InChIKeyIWCDHQJJKNXLHV-UHFFFAOYSA-N
XLogP0.86
TPSA78.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.38
LogP ≤ 50.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-(4-hydroxy-4-methylazepan-1-yl)-2-morpholin-2-ylethanone
CID 107404309
1-(3,3-dimethylpyrrolidin-1-yl)-2-morpholin-2-ylethanone;hydrochloride
CID 119781999
1-(azepan-1-yl)-2-morpholin-2-ylethanone
CID 66433560
4-propyl-1-(pyrrolidine-3-carbonyl)piperidine-4-carboxylic acid
CID 63125584
2-morpholin-2-yl-1-thiomorpholin-4-ylethanone
CID 66434733
1-(2-ethylmorpholin-4-yl)-2-morpholin-2-ylethanone
CID 66432993
1-(piperidine-3-carbonyl)-4-propylpiperidine-4-carboxylic acid
CID 63126106
1-(4-methylsulfonylpiperazin-1-yl)-2-morpholin-2-ylethanone;hydrochloride
CID 119696186
1-[4-[(dimethylamino)methyl]piperidin-1-yl]-2-morpholin-2-ylethanone
CID 66428289
N-methyl-1-(2-morpholin-2-ylacetyl)piperidine-4-carboxamide
CID 66433581
methyl 1-(2-morpholin-2-ylacetyl)piperidine-4-carboxylate
CID 66433180
2-morpholin-2-yl-1-(3-propoxypiperidin-1-yl)ethanone
CID 66427238

Frequently Asked Questions

What is the IUPAC name of 1-(2-morpholin-2-ylacetyl)-4-propylpiperidine-4-carboxylic acid?
The IUPAC name of 1-(2-morpholin-2-ylacetyl)-4-propylpiperidine-4-carboxylic acid (CID 66427689) is 1-(2-morpholin-2-ylacetyl)-4-propylpiperidine-4-carboxylic acid.
What is the SMILES notation for 1-(2-morpholin-2-ylacetyl)-4-propylpiperidine-4-carboxylic acid?
The canonical SMILES for 1-(2-morpholin-2-ylacetyl)-4-propylpiperidine-4-carboxylic acid is CCCC1(C(=O)O)CCN(C(=O)CC2CNCCO2)CC1.
What is the InChIKey of 1-(2-morpholin-2-ylacetyl)-4-propylpiperidine-4-carboxylic acid?
The InChIKey is IWCDHQJJKNXLHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O4/c1-2-3-15(14(19)20)4-7-17(8-5-15)13(18)10-12-11-16-6-9-21-12/h12,16H,2-11H2,1H3,(H,19,20).
What are the key properties of 1-(2-morpholin-2-ylacetyl)-4-propylpiperidine-4-carboxylic acid?
1-(2-morpholin-2-ylacetyl)-4-propylpiperidine-4-carboxylic acid has a molecular weight of 298.38 g/mol, XLogP of 0.86, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-morpholin-2-ylacetyl)-4-propylpiperidine-4-carboxylic acid is sourced from PubChem (CID 66427689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).