(2R)-1-(2-cyclopropylpropanoyl)piperidine-2-carboxylic acid

C12H19NO3 — CID 83146744

IUPAC(2R)-1-(2-cyclopropylpropanoyl)piperidine-2-carboxylic acid
SMILESCC(C(=O)N1CCCC[C@@H]1C(=O)O)C1CC1
InChIInChI=1S/C12H19NO3/c1-8(9-5-6-9)11(14)13-7-3-2-4-10(13)12(15)16/h8-10H,2-7H2,1H3,(H,15,16)/t8?,10-/m1/s1
InChIKeyCSNBURGTHSHLSC-LHIURRSHSA-N
MW225.29 g/mol
LogP1.50
Rot. Bonds3

About (2R)-1-(2-cyclopropylpropanoyl)piperidine-2-carboxylic acid

(2R)-1-(2-cyclopropylpropanoyl)piperidine-2-carboxylic acid (PubChem CID 83146744) has the molecular formula C12H19NO3 and a molecular weight of 225.29 g/mol. Its IUPAC name is (2R)-1-(2-cyclopropylpropanoyl)piperidine-2-carboxylic acid.

Molecular Properties

Compound Name(2R)-1-(2-cyclopropylpropanoyl)piperidine-2-carboxylic acid
PubChem CID83146744
Molecular FormulaC12H19NO3
Molecular Weight225.29 g/mol
Exact Mass225.14
IUPAC Name(2R)-1-(2-cyclopropylpropanoyl)piperidine-2-carboxylic acid
SMILESCC(C(=O)N1CCCC[C@@H]1C(=O)O)C1CC1
InChIInChI=1S/C12H19NO3/c1-8(9-5-6-9)11(14)13-7-3-2-4-10(13)12(15)16/h8-10H,2-7H2,1H3,(H,15,16)/t8?,10-/m1/s1
InChIKeyCSNBURGTHSHLSC-LHIURRSHSA-N
XLogP1.50
TPSA57.61 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.29
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[(2R)-2-aminopropanoyl]azepane-2-carboxylic acid
CID 78996683
1-(2-aminopropanoyl)azepane-2-carboxylic acid
CID 64564461
1-(2-amino-3-methylbutanoyl)azepane-2-carboxylic acid
CID 64562703
(2R)-1-(2-methylsulfonylpropanoyl)piperidine-2-carboxylic acid
CID 103953818
methyl 1-(2-cyclopropylpropanoyl)pyrrolidine-2-carboxylate
CID 79507346
1-(2-hydroxypropanoyl)pyrrolidine-2-carboxylic acid
CID 12919062
(2S)-1-(2,2-difluoroacetyl)piperidine-2-carboxylic acid
CID 103513364
(2R)-1-[2-(2,5-dimethylpyrrolidin-1-yl)propanoyl]piperidine-2-carboxylic acid
CID 79034494
(2R)-1-(2-aminopropanoyl)pyrrolidine-2-carboxylic acid
CID 23423034
(2R)-1-(2,3-dimethylbutanoyl)pyrrolidine-2-carboxylic acid
CID 78955955
(2S)-1-[(2R)-2-chloropropanoyl]pyrrolidine-2-carboxylic acid
CID 10845919
(2S)-1-[(2S)-2-amino-4-methylpentanoyl]piperidine-2-carboxylic acid
CID 66263946

Frequently Asked Questions

What is the IUPAC name of (2R)-1-(2-cyclopropylpropanoyl)piperidine-2-carboxylic acid?
The IUPAC name of (2R)-1-(2-cyclopropylpropanoyl)piperidine-2-carboxylic acid (CID 83146744) is (2R)-1-(2-cyclopropylpropanoyl)piperidine-2-carboxylic acid.
What is the SMILES notation for (2R)-1-(2-cyclopropylpropanoyl)piperidine-2-carboxylic acid?
The canonical SMILES for (2R)-1-(2-cyclopropylpropanoyl)piperidine-2-carboxylic acid is CC(C(=O)N1CCCC[C@@H]1C(=O)O)C1CC1.
What is the InChIKey of (2R)-1-(2-cyclopropylpropanoyl)piperidine-2-carboxylic acid?
The InChIKey is CSNBURGTHSHLSC-LHIURRSHSA-N. The full InChI is InChI=1S/C12H19NO3/c1-8(9-5-6-9)11(14)13-7-3-2-4-10(13)12(15)16/h8-10H,2-7H2,1H3,(H,15,16)/t8?,10-/m1/s1.
What are the key properties of (2R)-1-(2-cyclopropylpropanoyl)piperidine-2-carboxylic acid?
(2R)-1-(2-cyclopropylpropanoyl)piperidine-2-carboxylic acid has a molecular weight of 225.29 g/mol, XLogP of 1.50, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-(2-cyclopropylpropanoyl)piperidine-2-carboxylic acid is sourced from PubChem (CID 83146744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).