tert-butyl N-(4-hydroxy-2-methylbutan-2-yl)carbamate

C10H21NO3 — CID 15473340

IUPACtert-butyl N-(4-hydroxy-2-methylbutan-2-yl)carbamate
SMILESCC(C)(CCO)NC(=O)OC(C)(C)C
InChIInChI=1S/C10H21NO3/c1-9(2,3)14-8(13)11-10(4,5)6-7-12/h12H,6-7H2,1-5H3,(H,11,13)
InChIKeyQHSUFODBDZQCHO-UHFFFAOYSA-N
MW203.28 g/mol
LogP1.67
Rot. Bonds3

About tert-butyl N-(4-hydroxy-2-methylbutan-2-yl)carbamate

tert-butyl N-(4-hydroxy-2-methylbutan-2-yl)carbamate (PubChem CID 15473340) has the molecular formula C10H21NO3 and a molecular weight of 203.28 g/mol. Its IUPAC name is tert-butyl N-(4-hydroxy-2-methylbutan-2-yl)carbamate.

Molecular Properties

Compound Nametert-butyl N-(4-hydroxy-2-methylbutan-2-yl)carbamate
PubChem CID15473340
Molecular FormulaC10H21NO3
Molecular Weight203.28 g/mol
Exact Mass203.15
IUPAC Nametert-butyl N-(4-hydroxy-2-methylbutan-2-yl)carbamate
SMILESCC(C)(CCO)NC(=O)OC(C)(C)C
InChIInChI=1S/C10H21NO3/c1-9(2,3)14-8(13)11-10(4,5)6-7-12/h12H,6-7H2,1-5H3,(H,11,13)
InChIKeyQHSUFODBDZQCHO-UHFFFAOYSA-N
XLogP1.67
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.28
LogP ≤ 51.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

tert-butyl N-(1-(hydroxymethyl)cyclopropyl)carbamate
CID 11286907
tert-butyl N-(1-hydroxy-2-methylpropan-2-yl)carbamate
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tert-butyl N-[1-(2-hydroxyethyl)cyclopropyl]carbamate
CID 12993139
Tert-butyl 5-hydroxy-2-methylpentan-2-ylcarbamate
CID 21196030
tert-butyl N-(3-hydroxy-1-methylcyclobutyl)carbamate
CID 58773809
tert-butyl N-(3-hydroxy-2-methylbutan-2-yl)carbamate
CID 86730181
tert-butyl N-[1-(1-hydroxyethyl)cyclopropyl]carbamate
CID 115071732
tert-butyl N-[1-(fluoromethyl)-3-hydroxycyclobutyl]carbamate
CID 167730670
2-t-Butoxycarbonylamino-2-ethylpropane-1,3-diol
CID 22279696
[(2R)-2-fluoro-3-hydroxy-3-methylbutyl] N-tert-butylcarbamate
CID 142733178
tert-butyl N-(4,4-difluoro-1-hydroxy-2-methylbutan-2-yl)carbamate
CID 155277104
tert-butyl N-[(2R)-4,4-difluoro-1-hydroxy-2-methylbutan-2-yl]carbamate
CID 164145636

Frequently Asked Questions

What is the IUPAC name of tert-butyl N-(4-hydroxy-2-methylbutan-2-yl)carbamate?
The IUPAC name of tert-butyl N-(4-hydroxy-2-methylbutan-2-yl)carbamate (CID 15473340) is tert-butyl N-(4-hydroxy-2-methylbutan-2-yl)carbamate.
What is the SMILES notation for tert-butyl N-(4-hydroxy-2-methylbutan-2-yl)carbamate?
The canonical SMILES for tert-butyl N-(4-hydroxy-2-methylbutan-2-yl)carbamate is CC(C)(CCO)NC(=O)OC(C)(C)C.
What is the InChIKey of tert-butyl N-(4-hydroxy-2-methylbutan-2-yl)carbamate?
The InChIKey is QHSUFODBDZQCHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO3/c1-9(2,3)14-8(13)11-10(4,5)6-7-12/h12H,6-7H2,1-5H3,(H,11,13).
What are the key properties of tert-butyl N-(4-hydroxy-2-methylbutan-2-yl)carbamate?
tert-butyl N-(4-hydroxy-2-methylbutan-2-yl)carbamate has a molecular weight of 203.28 g/mol, XLogP of 1.67, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl N-(4-hydroxy-2-methylbutan-2-yl)carbamate is sourced from PubChem (CID 15473340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).