tert-butyl (2R)-2-amino-2-methylpyrrolidine-1-carboxylate

C10H20N2O2 — CID 154191796

IUPACtert-butyl (2R)-2-amino-2-methylpyrrolidine-1-carboxylate
SMILESCC(C)(C)OC(=O)N1CCC[C@]1(C)N
InChIInChI=1S/C10H20N2O2/c1-9(2,3)14-8(13)12-7-5-6-10(12,4)11/h5-7,11H2,1-4H3/t10-/m1/s1
InChIKeyHMVVMRMDMVTCEX-SNVBAGLBSA-N
MW200.28 g/mol
LogP1.69
Rot. Bonds

About tert-butyl (2R)-2-amino-2-methylpyrrolidine-1-carboxylate

tert-butyl (2R)-2-amino-2-methylpyrrolidine-1-carboxylate (PubChem CID 154191796) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is tert-butyl (2R)-2-amino-2-methylpyrrolidine-1-carboxylate.

Molecular Properties

Compound Nametert-butyl (2R)-2-amino-2-methylpyrrolidine-1-carboxylate
PubChem CID154191796
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC Nametert-butyl (2R)-2-amino-2-methylpyrrolidine-1-carboxylate
SMILESCC(C)(C)OC(=O)N1CCC[C@]1(C)N
InChIInChI=1S/C10H20N2O2/c1-9(2,3)14-8(13)12-7-5-6-10(12,4)11/h5-7,11H2,1-4H3/t10-/m1/s1
InChIKeyHMVVMRMDMVTCEX-SNVBAGLBSA-N
XLogP1.69
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

tert-butyl 2-amino-2-methylpiperidine-1-carboxylate
CID 69118170
ditert-butyl 2-methylpyrrolidine-1,2-dicarboxylate
CID 68574402
2-amino-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-2-carboxylic acid
CID 175733208
2-hydroxy-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid
CID 22556536
tert-butyl 2-oxa-5-azaspiro[3.4]octane-5-carboxylate
CID 54758971
2-methyl-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-2-carboxylic acid
CID 42614787
tert-butyl (3S)-3-amino-3-methylpiperidine-1-carboxylate;ethane
CID 155737634
(2R)-2-methyl-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-2-carboxylic acid
CID 27281688
(2R)-2-iodo-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid
CID 134421765
tert-butyl 1-oxa-8-azaspiro[3.4]octane-8-carboxylate
CID 71669234
(2S)-2-methyl-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-2-carboxylate
CID 27281685
tert-butyl 1,5-diazaspiro[3.5]nonane-5-carboxylate
CID 71741473

Frequently Asked Questions

What is the IUPAC name of tert-butyl (2R)-2-amino-2-methylpyrrolidine-1-carboxylate?
The IUPAC name of tert-butyl (2R)-2-amino-2-methylpyrrolidine-1-carboxylate (CID 154191796) is tert-butyl (2R)-2-amino-2-methylpyrrolidine-1-carboxylate.
What is the SMILES notation for tert-butyl (2R)-2-amino-2-methylpyrrolidine-1-carboxylate?
The canonical SMILES for tert-butyl (2R)-2-amino-2-methylpyrrolidine-1-carboxylate is CC(C)(C)OC(=O)N1CCC[C@]1(C)N.
What is the InChIKey of tert-butyl (2R)-2-amino-2-methylpyrrolidine-1-carboxylate?
The InChIKey is HMVVMRMDMVTCEX-SNVBAGLBSA-N. The full InChI is InChI=1S/C10H20N2O2/c1-9(2,3)14-8(13)12-7-5-6-10(12,4)11/h5-7,11H2,1-4H3/t10-/m1/s1.
What are the key properties of tert-butyl (2R)-2-amino-2-methylpyrrolidine-1-carboxylate?
tert-butyl (2R)-2-amino-2-methylpyrrolidine-1-carboxylate has a molecular weight of 200.28 g/mol, XLogP of 1.69, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl (2R)-2-amino-2-methylpyrrolidine-1-carboxylate is sourced from PubChem (CID 154191796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).