1-[1-(2-methoxyethyl)cyclopentanecarbonyl]piperidine-3-carboxylic acid

C15H25NO4 — CID 102553827

IUPAC1-[1-(2-methoxyethyl)cyclopentanecarbonyl]piperidine-3-carboxylic acid
SMILESCOCCC1(C(=O)N2CCCC(C(=O)O)C2)CCCC1
InChIInChI=1S/C15H25NO4/c1-20-10-8-15(6-2-3-7-15)14(19)16-9-4-5-12(11-16)13(17)18/h12H,2-11H2,1H3,(H,17,18)
InChIKeyFPCRVPRDWPOERL-UHFFFAOYSA-N
MW283.37 g/mol
LogP1.91
Rot. Bonds5

About 1-[1-(2-methoxyethyl)cyclopentanecarbonyl]piperidine-3-carboxylic acid

1-[1-(2-methoxyethyl)cyclopentanecarbonyl]piperidine-3-carboxylic acid (PubChem CID 102553827) has the molecular formula C15H25NO4 and a molecular weight of 283.37 g/mol. Its IUPAC name is 1-[1-(2-methoxyethyl)cyclopentanecarbonyl]piperidine-3-carboxylic acid.

Molecular Properties

Compound Name1-[1-(2-methoxyethyl)cyclopentanecarbonyl]piperidine-3-carboxylic acid
PubChem CID102553827
Molecular FormulaC15H25NO4
Molecular Weight283.37 g/mol
Exact Mass283.18
IUPAC Name1-[1-(2-methoxyethyl)cyclopentanecarbonyl]piperidine-3-carboxylic acid
SMILESCOCCC1(C(=O)N2CCCC(C(=O)O)C2)CCCC1
InChIInChI=1S/C15H25NO4/c1-20-10-8-15(6-2-3-7-15)14(19)16-9-4-5-12(11-16)13(17)18/h12H,2-11H2,1H3,(H,17,18)
InChIKeyFPCRVPRDWPOERL-UHFFFAOYSA-N
XLogP1.91
TPSA66.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.37
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3R)-1-[1-(2-methoxyethyl)cyclobutanecarbonyl]pyrrolidine-3-carboxylic acid
CID 124685754
(2S)-4-[1-(2-methoxyethyl)cyclopentanecarbonyl]morpholine-2-carboxylic acid
CID 125149728
(3S)-1-[1-(aminomethyl)cycloheptanecarbonyl]piperidine-3-carboxylic acid
CID 115444265
(3R)-1-(1-ethylcyclobutanecarbonyl)piperidine-3-carboxylic acid
CID 124576606
[(3R)-3-aminopyrrolidin-1-yl]-[1-(2-methoxyethyl)cyclobutyl]methanone
CID 119412473
3,9-diazabicyclo[4.2.1]nonan-3-yl-[1-(2-methoxyethyl)cyclopentyl]methanone
CID 119638958
[(3R)-3-(hydroxymethyl)pyrrolidin-1-yl]-[1-(2-methoxyethyl)cyclobutyl]methanone
CID 97246480
(3R,4R)-4-cyclopropyl-1-[1-(2-methoxyethyl)cyclopentanecarbonyl]pyrrolidine-3-carboxylic acid
CID 120978313
(3R)-1-(1-methylcyclopentanecarbonyl)piperidine-3-carboxylic acid
CID 81119321
[1-(2-methoxyethyl)cyclopentyl]-[4-(methylamino)piperidin-1-yl]methanone;hydrochloride
CID 119563582
(3R)-1-[2-(2-methoxyethoxy)acetyl]piperidine-3-carboxylic acid
CID 81118783
1-[2-(2-methoxyethoxy)acetyl]piperidine-3-carboxylic acid
CID 43355934

Frequently Asked Questions

What is the IUPAC name of 1-[1-(2-methoxyethyl)cyclopentanecarbonyl]piperidine-3-carboxylic acid?
The IUPAC name of 1-[1-(2-methoxyethyl)cyclopentanecarbonyl]piperidine-3-carboxylic acid (CID 102553827) is 1-[1-(2-methoxyethyl)cyclopentanecarbonyl]piperidine-3-carboxylic acid.
What is the SMILES notation for 1-[1-(2-methoxyethyl)cyclopentanecarbonyl]piperidine-3-carboxylic acid?
The canonical SMILES for 1-[1-(2-methoxyethyl)cyclopentanecarbonyl]piperidine-3-carboxylic acid is COCCC1(C(=O)N2CCCC(C(=O)O)C2)CCCC1.
What is the InChIKey of 1-[1-(2-methoxyethyl)cyclopentanecarbonyl]piperidine-3-carboxylic acid?
The InChIKey is FPCRVPRDWPOERL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO4/c1-20-10-8-15(6-2-3-7-15)14(19)16-9-4-5-12(11-16)13(17)18/h12H,2-11H2,1H3,(H,17,18).
What are the key properties of 1-[1-(2-methoxyethyl)cyclopentanecarbonyl]piperidine-3-carboxylic acid?
1-[1-(2-methoxyethyl)cyclopentanecarbonyl]piperidine-3-carboxylic acid has a molecular weight of 283.37 g/mol, XLogP of 1.91, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(2-methoxyethyl)cyclopentanecarbonyl]piperidine-3-carboxylic acid is sourced from PubChem (CID 102553827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).