1-cyclopentyl-4-ethylpiperidine-4-carboxylic acid

C13H23NO2 — CID 63126612

IUPAC1-cyclopentyl-4-ethylpiperidine-4-carboxylic acid
SMILESCCC1(C(=O)O)CCN(C2CCCC2)CC1
InChIInChI=1S/C13H23NO2/c1-2-13(12(15)16)7-9-14(10-8-13)11-5-3-4-6-11/h11H,2-10H2,1H3,(H,15,16)
InChIKeyORIWIEGJFXBRKI-UHFFFAOYSA-N
MW225.33 g/mol
LogP2.51
Rot. Bonds3

About 1-cyclopentyl-4-ethylpiperidine-4-carboxylic acid

1-cyclopentyl-4-ethylpiperidine-4-carboxylic acid (PubChem CID 63126612) has the molecular formula C13H23NO2 and a molecular weight of 225.33 g/mol. Its IUPAC name is 1-cyclopentyl-4-ethylpiperidine-4-carboxylic acid.

Molecular Properties

Compound Name1-cyclopentyl-4-ethylpiperidine-4-carboxylic acid
PubChem CID63126612
Molecular FormulaC13H23NO2
Molecular Weight225.33 g/mol
Exact Mass225.17
IUPAC Name1-cyclopentyl-4-ethylpiperidine-4-carboxylic acid
SMILESCCC1(C(=O)O)CCN(C2CCCC2)CC1
InChIInChI=1S/C13H23NO2/c1-2-13(12(15)16)7-9-14(10-8-13)11-5-3-4-6-11/h11H,2-10H2,1H3,(H,15,16)
InChIKeyORIWIEGJFXBRKI-UHFFFAOYSA-N
XLogP2.51
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.33
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-ethyl-1-(1-propan-2-ylazepan-4-yl)piperidine-4-carboxylic acid
CID 65076489
1-(1,1-dioxothian-3-yl)-3-ethylpyrrolidine-3-carboxylic acid
CID 65064274
1-(4-ethylcyclohexyl)-4-propylpiperidine-4-carboxylic acid
CID 64747380
1-cycloheptyl-4-hydroxypiperidine-4-carboxylic acid
CID 115055583
2-(1-cyclopentyl-4-methylpiperidin-4-yl)acetic acid
CID 117013254
3-ethyl-1-(4-methylcyclohexyl)piperidine-3-carboxylic acid
CID 64747777
1-cycloheptyl-3-propylpiperidine-3-carboxylic acid
CID 65068602
3-ethyl-1-(oxan-4-yl)piperidine-3-carboxylic acid
CID 63936052
1-[2-(cyclopentylamino)-2-oxoethyl]-4-ethylpiperidine-4-carboxylic acid
CID 63126585
(1-cyclopentyl-4-methylpiperidin-4-yl)methanol
CID 83915889
1-(oxepan-4-yl)-3-propylpyrrolidine-3-carboxylic acid
CID 65080564
1-(3-propan-2-ylcyclohexyl)-4-propylpiperidine-4-carboxylic acid
CID 107450485

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-4-ethylpiperidine-4-carboxylic acid?
The IUPAC name of 1-cyclopentyl-4-ethylpiperidine-4-carboxylic acid (CID 63126612) is 1-cyclopentyl-4-ethylpiperidine-4-carboxylic acid.
What is the SMILES notation for 1-cyclopentyl-4-ethylpiperidine-4-carboxylic acid?
The canonical SMILES for 1-cyclopentyl-4-ethylpiperidine-4-carboxylic acid is CCC1(C(=O)O)CCN(C2CCCC2)CC1.
What is the InChIKey of 1-cyclopentyl-4-ethylpiperidine-4-carboxylic acid?
The InChIKey is ORIWIEGJFXBRKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23NO2/c1-2-13(12(15)16)7-9-14(10-8-13)11-5-3-4-6-11/h11H,2-10H2,1H3,(H,15,16).
What are the key properties of 1-cyclopentyl-4-ethylpiperidine-4-carboxylic acid?
1-cyclopentyl-4-ethylpiperidine-4-carboxylic acid has a molecular weight of 225.33 g/mol, XLogP of 2.51, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-4-ethylpiperidine-4-carboxylic acid is sourced from PubChem (CID 63126612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).