tert-butyl N-[[(2R)-4-propan-2-ylmorpholin-2-yl]methyl]carbamate

C13H26N2O3 — CID 163975726

IUPACtert-butyl N-[[(2R)-4-propan-2-ylmorpholin-2-yl]methyl]carbamate
SMILESCC(C)N1CCO[C@H](CNC(=O)OC(C)(C)C)C1
InChIInChI=1S/C13H26N2O3/c1-10(2)15-6-7-17-11(9-15)8-14-12(16)18-13(3,4)5/h10-11H,6-9H2,1-5H3,(H,14,16)/t11-/m1/s1
InChIKeySTYLPACGMKRLFN-LLVKDONJSA-N
MW258.36 g/mol
LogP1.62
Rot. Bonds3

About tert-butyl N-[[(2R)-4-propan-2-ylmorpholin-2-yl]methyl]carbamate

tert-butyl N-[[(2R)-4-propan-2-ylmorpholin-2-yl]methyl]carbamate (PubChem CID 163975726) has the molecular formula C13H26N2O3 and a molecular weight of 258.36 g/mol. Its IUPAC name is tert-butyl N-[[(2R)-4-propan-2-ylmorpholin-2-yl]methyl]carbamate.

Molecular Properties

Compound Nametert-butyl N-[[(2R)-4-propan-2-ylmorpholin-2-yl]methyl]carbamate
PubChem CID163975726
Molecular FormulaC13H26N2O3
Molecular Weight258.36 g/mol
Exact Mass258.19
IUPAC Nametert-butyl N-[[(2R)-4-propan-2-ylmorpholin-2-yl]methyl]carbamate
SMILESCC(C)N1CCO[C@H](CNC(=O)OC(C)(C)C)C1
InChIInChI=1S/C13H26N2O3/c1-10(2)15-6-7-17-11(9-15)8-14-12(16)18-13(3,4)5/h10-11H,6-9H2,1-5H3,(H,14,16)/t11-/m1/s1
InChIKeySTYLPACGMKRLFN-LLVKDONJSA-N
XLogP1.62
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.36
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze tert-butyl N-[[(2R)-4-propan-2-ylmorpholin-2-yl]methyl]carbamate with MolForge

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Related Compounds

(2S)-2-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]morpholine-4-carboxylic acid
CID 68684608
N-[(2-methylpropan-2-yl)oxy]-1-(4-propan-2-ylmorpholin-2-yl)methanamine
CID 82723781
tert-butyl N-[(1-propan-2-ylpiperidin-4-yl)methyl]carbamate
CID 20801241
2,3-dimethyl-3-[(4-propan-2-ylmorpholin-2-yl)methylamino]butan-2-ol
CID 106189997
4-[(4-propan-2-ylmorpholin-2-yl)methylamino]butanoic acid
CID 64534544
tert-butyl N-[[(2S)-4-[(3,4-dimethylphenyl)methyl]morpholin-2-yl]methyl]carbamate
CID 143491953
tert-butyl N-[2-[[N'-methyl-N-[(4-methylmorpholin-2-yl)methyl]carbamimidoyl]amino]ethyl]carbamate;hydroiodide
CID 111884988
tert-butyl N-[[(2S)-morpholin-2-yl]methyl]carbamate
CID 42556133
tert-butyl N-[[(2S)-4-[(3-chloro-4-methylphenyl)methyl]morpholin-2-yl]methyl]carbamate;ethane
CID 143612680
tert-butyl N-[3-[(4-ethylmorpholin-2-yl)methylamino]propyl]carbamate
CID 114399643
2,2,2-trifluoro-N-[(4-propan-2-ylmorpholin-2-yl)methyl]ethanamine
CID 64532686
3-chloro-N-[(4-propan-2-ylmorpholin-2-yl)methyl]butan-1-amine
CID 65024909

Frequently Asked Questions

What is the IUPAC name of tert-butyl N-[[(2R)-4-propan-2-ylmorpholin-2-yl]methyl]carbamate?
The IUPAC name of tert-butyl N-[[(2R)-4-propan-2-ylmorpholin-2-yl]methyl]carbamate (CID 163975726) is tert-butyl N-[[(2R)-4-propan-2-ylmorpholin-2-yl]methyl]carbamate.
What is the SMILES notation for tert-butyl N-[[(2R)-4-propan-2-ylmorpholin-2-yl]methyl]carbamate?
The canonical SMILES for tert-butyl N-[[(2R)-4-propan-2-ylmorpholin-2-yl]methyl]carbamate is CC(C)N1CCO[C@H](CNC(=O)OC(C)(C)C)C1.
What is the InChIKey of tert-butyl N-[[(2R)-4-propan-2-ylmorpholin-2-yl]methyl]carbamate?
The InChIKey is STYLPACGMKRLFN-LLVKDONJSA-N. The full InChI is InChI=1S/C13H26N2O3/c1-10(2)15-6-7-17-11(9-15)8-14-12(16)18-13(3,4)5/h10-11H,6-9H2,1-5H3,(H,14,16)/t11-/m1/s1.
What are the key properties of tert-butyl N-[[(2R)-4-propan-2-ylmorpholin-2-yl]methyl]carbamate?
tert-butyl N-[[(2R)-4-propan-2-ylmorpholin-2-yl]methyl]carbamate has a molecular weight of 258.36 g/mol, XLogP of 1.62, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl N-[[(2R)-4-propan-2-ylmorpholin-2-yl]methyl]carbamate is sourced from PubChem (CID 163975726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).