(2S)-1-(methylamino)piperidine-2-carboxylic acid

C7H14N2O2 — CID 150133539

IUPAC(2S)-1-(methylamino)piperidine-2-carboxylic acid
SMILESCNN1CCCC[C@H]1C(=O)O
InChIInChI=1S/C7H14N2O2/c1-8-9-5-3-2-4-6(9)7(10)11/h6,8H,2-5H2,1H3,(H,10,11)/t6-/m0/s1
InChIKeyFBTFRWVRFXJAJR-LURJTMIESA-N
MW158.20 g/mol
LogP0.06
Rot. Bonds2

About (2S)-1-(methylamino)piperidine-2-carboxylic acid

(2S)-1-(methylamino)piperidine-2-carboxylic acid (PubChem CID 150133539) has the molecular formula C7H14N2O2 and a molecular weight of 158.20 g/mol. Its IUPAC name is (2S)-1-(methylamino)piperidine-2-carboxylic acid.

Molecular Properties

Compound Name(2S)-1-(methylamino)piperidine-2-carboxylic acid
PubChem CID150133539
Molecular FormulaC7H14N2O2
Molecular Weight158.20 g/mol
Exact Mass158.11
IUPAC Name(2S)-1-(methylamino)piperidine-2-carboxylic acid
SMILESCNN1CCCC[C@H]1C(=O)O
InChIInChI=1S/C7H14N2O2/c1-8-9-5-3-2-4-6(9)7(10)11/h6,8H,2-5H2,1H3,(H,10,11)/t6-/m0/s1
InChIKeyFBTFRWVRFXJAJR-LURJTMIESA-N
XLogP0.06
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.20
LogP ≤ 50.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-[1-(methylamino)piperidin-2-yl]ethanone
CID 91056798
hydron;1-methylpiperidine-2-carboxylic acid;chloride
CID 44558462
(2R)-1-aminopiperidine-2-carboxylic acid
CID 92556917
1-acetylpiperidine-2-carboxylic acid;ethane
CID 144674830
(2R)-1-methylpiperidine-2-carboxylic acid;1-[(2R)-1-methylpiperidin-2-yl]ethanone
CID 160589871
ethane;1-propan-2-ylpiperidine-2-carboxylic acid
CID 144742898
(2S)-1-(ethylcarbamoyl)piperidine-2-carboxylic acid
CID 66264798
(2S)-1-methylpyrrolidine-2-carboxylic acid
CID 158548617
(2S)-1-(2,2-difluoroacetyl)piperidine-2-carboxylic acid
CID 103513364
(2S)-1-formylpiperidine-2-carboxylic acid
CID 65439701
1-(methoxysulfamoyl)piperidine-2-carboxylic acid
CID 64974074
1-(1-methoxy-1-oxopropan-2-yl)piperidine-2-carboxylic acid
CID 82223955

Frequently Asked Questions

What is the IUPAC name of (2S)-1-(methylamino)piperidine-2-carboxylic acid?
The IUPAC name of (2S)-1-(methylamino)piperidine-2-carboxylic acid (CID 150133539) is (2S)-1-(methylamino)piperidine-2-carboxylic acid.
What is the SMILES notation for (2S)-1-(methylamino)piperidine-2-carboxylic acid?
The canonical SMILES for (2S)-1-(methylamino)piperidine-2-carboxylic acid is CNN1CCCC[C@H]1C(=O)O.
What is the InChIKey of (2S)-1-(methylamino)piperidine-2-carboxylic acid?
The InChIKey is FBTFRWVRFXJAJR-LURJTMIESA-N. The full InChI is InChI=1S/C7H14N2O2/c1-8-9-5-3-2-4-6(9)7(10)11/h6,8H,2-5H2,1H3,(H,10,11)/t6-/m0/s1.
What are the key properties of (2S)-1-(methylamino)piperidine-2-carboxylic acid?
(2S)-1-(methylamino)piperidine-2-carboxylic acid has a molecular weight of 158.20 g/mol, XLogP of 0.06, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-1-(methylamino)piperidine-2-carboxylic acid is sourced from PubChem (CID 150133539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).