methyl (2R)-1-aminopiperidine-2-carboxylate

C7H14N2O2 — CID 90433668

IUPACmethyl (2R)-1-aminopiperidine-2-carboxylate
SMILESCOC(=O)[C@H]1CCCCN1N
InChIInChI=1S/C7H14N2O2/c1-11-7(10)6-4-2-3-5-9(6)8/h6H,2-5,8H2,1H3/t6-/m1/s1
InChIKeyAIJCHRINRXYGIF-ZCFIWIBFSA-N
MW158.20 g/mol
LogP-0.11
Rot. Bonds1

About methyl (2R)-1-aminopiperidine-2-carboxylate

methyl (2R)-1-aminopiperidine-2-carboxylate (PubChem CID 90433668) has the molecular formula C7H14N2O2 and a molecular weight of 158.20 g/mol. Its IUPAC name is methyl (2R)-1-aminopiperidine-2-carboxylate.

Molecular Properties

Compound Namemethyl (2R)-1-aminopiperidine-2-carboxylate
PubChem CID90433668
Molecular FormulaC7H14N2O2
Molecular Weight158.20 g/mol
Exact Mass158.11
IUPAC Namemethyl (2R)-1-aminopiperidine-2-carboxylate
SMILESCOC(=O)[C@H]1CCCCN1N
InChIInChI=1S/C7H14N2O2/c1-11-7(10)6-4-2-3-5-9(6)8/h6H,2-5,8H2,1H3/t6-/m1/s1
InChIKeyAIJCHRINRXYGIF-ZCFIWIBFSA-N
XLogP-0.11
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.20
LogP ≤ 5-0.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

methyl (2R)-1-(cyclopentanecarbonyl)piperidine-2-carboxylate
CID 79833170
methyl (2R)-1-(cyclopropanecarbonyl)piperidine-2-carboxylate
CID 79833593
(2R)-1-aminopiperidine-2-carboxylic acid
CID 92556917
dimethylamino 1-aminopyrrolidine-2-carboxylate
CID 140504713
1-(1-aminopiperidin-2-yl)propan-1-one
CID 57118405
2-methoxycarbonylpiperidine-1-sulfinic acid
CID 163587871
methyl 1-cyclopropylsulfonylpiperidine-2-carboxylate
CID 79033025
methyl 1-methylpyrrolidine-2-carboxylate
CID 529062
methyl (2S)-1-hydroxypyrrolidine-2-carboxylate
CID 11240554
methyl 1-[1-(cyclopropanecarbonyl)pyrrolidine-2-carbonyl]pyrrolidine-2-carboxylate
CID 43623815
methyl (2R)-1-pyrrolidin-1-ylsulfonylpiperidine-2-carboxylate
CID 79830606
methyl 1-(5-aminopentyl)piperidine-2-carboxylate
CID 115533674

Frequently Asked Questions

What is the IUPAC name of methyl (2R)-1-aminopiperidine-2-carboxylate?
The IUPAC name of methyl (2R)-1-aminopiperidine-2-carboxylate (CID 90433668) is methyl (2R)-1-aminopiperidine-2-carboxylate.
What is the SMILES notation for methyl (2R)-1-aminopiperidine-2-carboxylate?
The canonical SMILES for methyl (2R)-1-aminopiperidine-2-carboxylate is COC(=O)[C@H]1CCCCN1N.
What is the InChIKey of methyl (2R)-1-aminopiperidine-2-carboxylate?
The InChIKey is AIJCHRINRXYGIF-ZCFIWIBFSA-N. The full InChI is InChI=1S/C7H14N2O2/c1-11-7(10)6-4-2-3-5-9(6)8/h6H,2-5,8H2,1H3/t6-/m1/s1.
What are the key properties of methyl (2R)-1-aminopiperidine-2-carboxylate?
methyl (2R)-1-aminopiperidine-2-carboxylate has a molecular weight of 158.20 g/mol, XLogP of -0.11, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl (2R)-1-aminopiperidine-2-carboxylate is sourced from PubChem (CID 90433668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).