1-cyclopentyl-6-oxopiperidine-3-carboxylic acid

C11H17NO3 — CID 44827692

IUPAC1-cyclopentyl-6-oxopiperidine-3-carboxylic acid
SMILESO=C(O)C1CCC(=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)
InChIKeyMITBXWOAYZPGJN-UHFFFAOYSA-N
MW211.26 g/mol
LogP1.25
Rot. Bonds2

About 1-cyclopentyl-6-oxopiperidine-3-carboxylic acid

1-cyclopentyl-6-oxopiperidine-3-carboxylic acid (PubChem CID 44827692) has the molecular formula C11H17NO3 and a molecular weight of 211.26 g/mol. Its IUPAC name is 1-cyclopentyl-6-oxopiperidine-3-carboxylic acid.

Molecular Properties

Compound Name1-cyclopentyl-6-oxopiperidine-3-carboxylic acid
PubChem CID44827692
Molecular FormulaC11H17NO3
Molecular Weight211.26 g/mol
Exact Mass211.12
IUPAC Name1-cyclopentyl-6-oxopiperidine-3-carboxylic acid
SMILESO=C(O)C1CCC(=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)
InChIKeyMITBXWOAYZPGJN-UHFFFAOYSA-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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Related Compounds

(6R,8aS)-3-oxo-2,5,6,7,8,8a-hexahydro-1H-indolizine-6-carboxylic acid
CID 86727694
(6S,8aR)-3-oxo-2,5,6,7,8,8a-hexahydro-1H-indolizine-6-carboxylic acid
CID 86727879
(6R,8aR)-3-oxo-2,5,6,7,8,8a-hexahydro-1H-indolizine-6-carboxylic acid
CID 129388955
6-oxo-1-(3,3,5,5-tetramethylcyclohexyl)piperidine-3-carboxylic acid
CID 103968342
1-cycloheptyl-5-(1,2-oxazolidine-2-carbonyl)piperidin-2-one
CID 45189435
1-(3-carboxycyclohexyl)-5-oxopyrrolidine-3-carboxylic acid
CID 168690108
1-(1,1-dioxothian-4-yl)-5-oxopyrrolidine-3-carboxylic acid
CID 43614759
1-(2,3-dimethylcyclopentyl)-6-oxopiperidine-3-carboxylic acid
CID 64920899
1-methyl-6-oxopiperidine-3-carboxylic acid
CID 25247731
(5R)-1-cyclopentyl-5-[4-(1H-1,2,4-triazol-5-yl)piperazine-1-carbonyl]piperidin-2-one
CID 126451283
(3S)-1-cyclopentyl-5-oxopyrrolidine-3-carboxamide
CID 29451208
(3R)-1-cyclopentyl-5-oxopyrrolidine-3-carboxylate
CID 6942092

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-6-oxopiperidine-3-carboxylic acid?
The IUPAC name of 1-cyclopentyl-6-oxopiperidine-3-carboxylic acid (CID 44827692) is 1-cyclopentyl-6-oxopiperidine-3-carboxylic acid.
What is the SMILES notation for 1-cyclopentyl-6-oxopiperidine-3-carboxylic acid?
The canonical SMILES for 1-cyclopentyl-6-oxopiperidine-3-carboxylic acid is O=C(O)C1CCC(=O)N(C2CCCC2)C1.
What is the InChIKey of 1-cyclopentyl-6-oxopiperidine-3-carboxylic acid?
The InChIKey is MITBXWOAYZPGJN-UHFFFAOYSA-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).
What are the key properties of 1-cyclopentyl-6-oxopiperidine-3-carboxylic acid?
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 1-cyclopentyl-6-oxopiperidine-3-carboxylic acid is sourced from PubChem (CID 44827692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).