tert-butyl N-[(2R)-3-methylbutan-2-yl]carbamate

C10H21NO2 — CID 11014358

IUPACtert-butyl N-[(2R)-3-methylbutan-2-yl]carbamate
SMILESCC(C)[C@@H](C)NC(=O)OC(C)(C)C
InChIInChI=1S/C10H21NO2/c1-7(2)8(3)11-9(12)13-10(4,5)6/h7-8H,1-6H3,(H,11,12)/t8-/m1/s1
InChIKeyAXYWAWQXZRZXSM-MRVPVSSYSA-N
MW187.28 g/mol
LogP2.56
Rot. Bonds2

About tert-butyl N-[(2R)-3-methylbutan-2-yl]carbamate

tert-butyl N-[(2R)-3-methylbutan-2-yl]carbamate (PubChem CID 11014358) has the molecular formula C10H21NO2 and a molecular weight of 187.28 g/mol. Its IUPAC name is tert-butyl N-[(2R)-3-methylbutan-2-yl]carbamate.

Molecular Properties

Compound Nametert-butyl N-[(2R)-3-methylbutan-2-yl]carbamate
PubChem CID11014358
Molecular FormulaC10H21NO2
Molecular Weight187.28 g/mol
Exact Mass187.16
IUPAC Nametert-butyl N-[(2R)-3-methylbutan-2-yl]carbamate
SMILESCC(C)[C@@H](C)NC(=O)OC(C)(C)C
InChIInChI=1S/C10H21NO2/c1-7(2)8(3)11-9(12)13-10(4,5)6/h7-8H,1-6H3,(H,11,12)/t8-/m1/s1
InChIKeyAXYWAWQXZRZXSM-MRVPVSSYSA-N
XLogP2.56
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.28
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

tert-butyl N-[(2R,3S)-3,4-dimethylpentan-2-yl]carbamate
CID 174039144
(2R)-2-methyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid
CID 87381369
(2S)-2-methyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid
CID 122505376
methyl N-(3-methylbutan-2-yl)carbamate
CID 3614647
tert-butyl N-(1-hydroxy-2-methylpropyl)carbamate
CID 23292073
2-methyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate
CID 71435357
tert-butyl N-[(2S,3S)-4-amino-3-methyl-4-oxobutan-2-yl]carbamate
CID 130935417
tert-butyl N-[(2S,3S,6R,7S)-3,6-dihydroxy-7-[(2-methylpropan-2-yl)oxycarbonylamino]octan-2-yl]carbamate
CID 11079337
tert-butyl N-[(2S)-1-bromo-1-methoxypropan-2-yl]carbamate
CID 175914357
(2S,3R)-2-amino-3-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid
CID 89219629
methyl 2-amino-3-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate
CID 76779344
lithium 2-hydroxy-3-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate
CID 162520562

Frequently Asked Questions

What is the IUPAC name of tert-butyl N-[(2R)-3-methylbutan-2-yl]carbamate?
The IUPAC name of tert-butyl N-[(2R)-3-methylbutan-2-yl]carbamate (CID 11014358) is tert-butyl N-[(2R)-3-methylbutan-2-yl]carbamate.
What is the SMILES notation for tert-butyl N-[(2R)-3-methylbutan-2-yl]carbamate?
The canonical SMILES for tert-butyl N-[(2R)-3-methylbutan-2-yl]carbamate is CC(C)[C@@H](C)NC(=O)OC(C)(C)C.
What is the InChIKey of tert-butyl N-[(2R)-3-methylbutan-2-yl]carbamate?
The InChIKey is AXYWAWQXZRZXSM-MRVPVSSYSA-N. The full InChI is InChI=1S/C10H21NO2/c1-7(2)8(3)11-9(12)13-10(4,5)6/h7-8H,1-6H3,(H,11,12)/t8-/m1/s1.
What are the key properties of tert-butyl N-[(2R)-3-methylbutan-2-yl]carbamate?
tert-butyl N-[(2R)-3-methylbutan-2-yl]carbamate has a molecular weight of 187.28 g/mol, XLogP of 2.56, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl N-[(2R)-3-methylbutan-2-yl]carbamate is sourced from PubChem (CID 11014358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).