1-(1-cyclopentylethyl)piperidine-4-carboxylic acid

C13H23NO2 — CID 65056131

IUPAC1-(1-cyclopentylethyl)piperidine-4-carboxylic acid
SMILESCC(C1CCCC1)N1CCC(C(=O)O)CC1
InChIInChI=1S/C13H23NO2/c1-10(11-4-2-3-5-11)14-8-6-12(7-9-14)13(15)16/h10-12H,2-9H2,1H3,(H,15,16)
InChIKeyDMZHHDYKFHADLN-UHFFFAOYSA-N
MW225.33 g/mol
LogP2.36
Rot. Bonds3

About 1-(1-cyclopentylethyl)piperidine-4-carboxylic acid

1-(1-cyclopentylethyl)piperidine-4-carboxylic acid (PubChem CID 65056131) has the molecular formula C13H23NO2 and a molecular weight of 225.33 g/mol. Its IUPAC name is 1-(1-cyclopentylethyl)piperidine-4-carboxylic acid.

Molecular Properties

Compound Name1-(1-cyclopentylethyl)piperidine-4-carboxylic acid
PubChem CID65056131
Molecular FormulaC13H23NO2
Molecular Weight225.33 g/mol
Exact Mass225.17
IUPAC Name1-(1-cyclopentylethyl)piperidine-4-carboxylic acid
SMILESCC(C1CCCC1)N1CCC(C(=O)O)CC1
InChIInChI=1S/C13H23NO2/c1-10(11-4-2-3-5-11)14-8-6-12(7-9-14)13(15)16/h10-12H,2-9H2,1H3,(H,15,16)
InChIKeyDMZHHDYKFHADLN-UHFFFAOYSA-N
XLogP2.36
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 ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(1-cyclopentylethyl)pyrrolidine-3-carboxylic acid
CID 65066559
3-[1-(1-cyclohexylethyl)piperidin-4-yl]propanoic acid
CID 65062735
1-butan-2-ylpiperidine-4-carboxylic acid
CID 43441619
2-[4-(1-cyclopentylethyl)-1,4-diazepan-1-yl]acetic acid
CID 65061835
1-[1-(cyclohexylcarbamoylamino)-1-oxopropan-2-yl]piperidine-4-carboxylic acid
CID 119906559
1-[1-(1-cyclohexylethyl)piperidin-4-yl]ethanamine
CID 63596713
2-[4-(1-cyclopropylethyl)piperazin-1-yl]propanoic acid
CID 65062404
1-propan-2-ylazepane-3-carboxylic acid
CID 83618658
1-(1-cyclopentylethyl)-2-methylpyrrolidine-3-carboxylic acid
CID 79383655
1-(1-cyclopentylethyl)-3-methylpiperidine-3-carboxylic acid
CID 65068812
1-[1-[(4-methylcyclohexyl)amino]-1-oxopropan-2-yl]piperidine-4-carboxylic acid
CID 119908292
cyclopentanecarboxylic acid
CID 18840

Frequently Asked Questions

What is the IUPAC name of 1-(1-cyclopentylethyl)piperidine-4-carboxylic acid?
The IUPAC name of 1-(1-cyclopentylethyl)piperidine-4-carboxylic acid (CID 65056131) is 1-(1-cyclopentylethyl)piperidine-4-carboxylic acid.
What is the SMILES notation for 1-(1-cyclopentylethyl)piperidine-4-carboxylic acid?
The canonical SMILES for 1-(1-cyclopentylethyl)piperidine-4-carboxylic acid is CC(C1CCCC1)N1CCC(C(=O)O)CC1.
What is the InChIKey of 1-(1-cyclopentylethyl)piperidine-4-carboxylic acid?
The InChIKey is DMZHHDYKFHADLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23NO2/c1-10(11-4-2-3-5-11)14-8-6-12(7-9-14)13(15)16/h10-12H,2-9H2,1H3,(H,15,16).
What are the key properties of 1-(1-cyclopentylethyl)piperidine-4-carboxylic acid?
1-(1-cyclopentylethyl)piperidine-4-carboxylic acid has a molecular weight of 225.33 g/mol, XLogP of 2.36, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-cyclopentylethyl)piperidine-4-carboxylic acid is sourced from PubChem (CID 65056131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).