(3R)-1-(2-cyclopentyloxyethylcarbamoyl)piperidine-3-carboxylic acid

C14H24N2O4 — CID 81120067

IUPAC(3R)-1-(2-cyclopentyloxyethylcarbamoyl)piperidine-3-carboxylic acid
SMILESO=C(O)[C@@H]1CCCN(C(=O)NCCOC2CCCC2)C1
InChIInChI=1S/C14H24N2O4/c17-13(18)11-4-3-8-16(10-11)14(19)15-7-9-20-12-5-1-2-6-12/h11-12H,1-10H2,(H,15,19)(H,17,18)/t11-/m1/s1
InChIKeyUSUFKVKVUBQPFK-LLVKDONJSA-N
MW284.36 g/mol
LogP1.45
Rot. Bonds5

About (3R)-1-(2-cyclopentyloxyethylcarbamoyl)piperidine-3-carboxylic acid

(3R)-1-(2-cyclopentyloxyethylcarbamoyl)piperidine-3-carboxylic acid (PubChem CID 81120067) has the molecular formula C14H24N2O4 and a molecular weight of 284.36 g/mol. Its IUPAC name is (3R)-1-(2-cyclopentyloxyethylcarbamoyl)piperidine-3-carboxylic acid.

Molecular Properties

Compound Name(3R)-1-(2-cyclopentyloxyethylcarbamoyl)piperidine-3-carboxylic acid
PubChem CID81120067
Molecular FormulaC14H24N2O4
Molecular Weight284.36 g/mol
Exact Mass284.17
IUPAC Name(3R)-1-(2-cyclopentyloxyethylcarbamoyl)piperidine-3-carboxylic acid
SMILESO=C(O)[C@@H]1CCCN(C(=O)NCCOC2CCCC2)C1
InChIInChI=1S/C14H24N2O4/c17-13(18)11-4-3-8-16(10-11)14(19)15-7-9-20-12-5-1-2-6-12/h11-12H,1-10H2,(H,15,19)(H,17,18)/t11-/m1/s1
InChIKeyUSUFKVKVUBQPFK-LLVKDONJSA-N
XLogP1.45
TPSA78.87 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 51.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

(3S)-1-(2-cyclopentyloxyethylcarbamoyl)piperidine-3-carboxylic acid
CID 81125882
(3S)-1-(2-methoxyethylcarbamoyl)piperidine-3-carboxylic acid
CID 28512077
(3S)-1-[2-(3-methylbutoxy)ethylcarbamoyl]piperidine-3-carboxylic acid
CID 81125959
(3R)-1-[2-(2-methoxyethoxy)ethylcarbamoyl]piperidine-3-carboxylic acid
CID 81119985
(3S)-1-(2-cyclopentylethylcarbamoyl)piperidine-3-carboxylic acid
CID 81125798
1-(2-chloroethylcarbamoyl)piperidine-3-carboxylic acid
CID 16769399
1-(cyclohexylmethylcarbamoyl)piperidine-3-carboxylic acid
CID 43371699
1-[2-(carbamoylamino)ethylcarbamoyl]piperidine-3-carboxylic acid
CID 83113986
(3R)-1-[2-(carbamoylamino)ethylcarbamoyl]piperidine-3-carboxylic acid
CID 83114124
(3S)-1-(2-acetamidoethylcarbamoyl)piperidine-3-carboxylic acid
CID 81125266
(3S)-1-(cyclopropylmethylcarbamoyl)piperidine-3-carboxylic acid
CID 81126444
(3R)-1-(but-3-ynylcarbamoyl)piperidine-3-carboxylic acid
CID 81120069

Frequently Asked Questions

What is the IUPAC name of (3R)-1-(2-cyclopentyloxyethylcarbamoyl)piperidine-3-carboxylic acid?
The IUPAC name of (3R)-1-(2-cyclopentyloxyethylcarbamoyl)piperidine-3-carboxylic acid (CID 81120067) is (3R)-1-(2-cyclopentyloxyethylcarbamoyl)piperidine-3-carboxylic acid.
What is the SMILES notation for (3R)-1-(2-cyclopentyloxyethylcarbamoyl)piperidine-3-carboxylic acid?
The canonical SMILES for (3R)-1-(2-cyclopentyloxyethylcarbamoyl)piperidine-3-carboxylic acid is O=C(O)[C@@H]1CCCN(C(=O)NCCOC2CCCC2)C1.
What is the InChIKey of (3R)-1-(2-cyclopentyloxyethylcarbamoyl)piperidine-3-carboxylic acid?
The InChIKey is USUFKVKVUBQPFK-LLVKDONJSA-N. The full InChI is InChI=1S/C14H24N2O4/c17-13(18)11-4-3-8-16(10-11)14(19)15-7-9-20-12-5-1-2-6-12/h11-12H,1-10H2,(H,15,19)(H,17,18)/t11-/m1/s1.
What are the key properties of (3R)-1-(2-cyclopentyloxyethylcarbamoyl)piperidine-3-carboxylic acid?
(3R)-1-(2-cyclopentyloxyethylcarbamoyl)piperidine-3-carboxylic acid has a molecular weight of 284.36 g/mol, XLogP of 1.45, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-1-(2-cyclopentyloxyethylcarbamoyl)piperidine-3-carboxylic acid is sourced from PubChem (CID 81120067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).