(3R)-1-cyclopentyl-6-oxopiperidine-3-carboxylic acid

C11H17NO3 — CID 42546168

IUPAC(3R)-1-cyclopentyl-6-oxopiperidine-3-carboxylic acid
SMILESO=C(O)[C@@H]1CCC(=O)N(C2CCCC2)C1
InChIInChI=1S/C11H17NO3/c13-10-6-5-8(11(14)15)7-12(10)9-3-1-2-4-9/h8-9H,1-7H2,(H,14,15)/t8-/m1/s1
InChIKeyMITBXWOAYZPGJN-MRVPVSSYSA-N
MW211.26 g/mol
LogP1.25
Rot. Bonds2

About (3R)-1-cyclopentyl-6-oxopiperidine-3-carboxylic acid

(3R)-1-cyclopentyl-6-oxopiperidine-3-carboxylic acid (PubChem CID 42546168) has the molecular formula C11H17NO3 and a molecular weight of 211.26 g/mol. Its IUPAC name is (3R)-1-cyclopentyl-6-oxopiperidine-3-carboxylic acid.

Molecular Properties

Compound Name(3R)-1-cyclopentyl-6-oxopiperidine-3-carboxylic acid
PubChem CID42546168
Molecular FormulaC11H17NO3
Molecular Weight211.26 g/mol
Exact Mass211.12
IUPAC Name(3R)-1-cyclopentyl-6-oxopiperidine-3-carboxylic acid
SMILESO=C(O)[C@@H]1CCC(=O)N(C2CCCC2)C1
InChIInChI=1S/C11H17NO3/c13-10-6-5-8(11(14)15)7-12(10)9-3-1-2-4-9/h8-9H,1-7H2,(H,14,15)/t8-/m1/s1
InChIKeyMITBXWOAYZPGJN-MRVPVSSYSA-N
XLogP1.25
TPSA57.61 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.26
LogP ≤ 51.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (3R)-1-cyclopentyl-6-oxopiperidine-3-carboxylic acid?
The IUPAC name of (3R)-1-cyclopentyl-6-oxopiperidine-3-carboxylic acid (CID 42546168) is (3R)-1-cyclopentyl-6-oxopiperidine-3-carboxylic acid.
What is the SMILES notation for (3R)-1-cyclopentyl-6-oxopiperidine-3-carboxylic acid?
The canonical SMILES for (3R)-1-cyclopentyl-6-oxopiperidine-3-carboxylic acid is O=C(O)[C@@H]1CCC(=O)N(C2CCCC2)C1.
What is the InChIKey of (3R)-1-cyclopentyl-6-oxopiperidine-3-carboxylic acid?
The InChIKey is MITBXWOAYZPGJN-MRVPVSSYSA-N. The full InChI is InChI=1S/C11H17NO3/c13-10-6-5-8(11(14)15)7-12(10)9-3-1-2-4-9/h8-9H,1-7H2,(H,14,15)/t8-/m1/s1.
What are the key properties of (3R)-1-cyclopentyl-6-oxopiperidine-3-carboxylic acid?
(3R)-1-cyclopentyl-6-oxopiperidine-3-carboxylic acid has a molecular weight of 211.26 g/mol, XLogP of 1.25, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-1-cyclopentyl-6-oxopiperidine-3-carboxylic acid is sourced from PubChem (CID 42546168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).