tert-butyl N-[2-[(2-methylpropan-2-yl)oxy]ethyl]carbamate

C11H23NO3 — CID 11195314

IUPACtert-butyl N-[2-[(2-methylpropan-2-yl)oxy]ethyl]carbamate
SMILESCC(C)(C)OCCNC(=O)OC(C)(C)C
InChIInChI=1S/C11H23NO3/c1-10(2,3)14-8-7-12-9(13)15-11(4,5)6/h7-8H2,1-6H3,(H,12,13)
InChIKeyWONBCUZALBPWES-UHFFFAOYSA-N
MW217.31 g/mol
LogP2.33
Rot. Bonds3

About tert-butyl N-[2-[(2-methylpropan-2-yl)oxy]ethyl]carbamate

tert-butyl N-[2-[(2-methylpropan-2-yl)oxy]ethyl]carbamate (PubChem CID 11195314) has the molecular formula C11H23NO3 and a molecular weight of 217.31 g/mol. Its IUPAC name is tert-butyl N-[2-[(2-methylpropan-2-yl)oxy]ethyl]carbamate.

Molecular Properties

Compound Nametert-butyl N-[2-[(2-methylpropan-2-yl)oxy]ethyl]carbamate
PubChem CID11195314
Molecular FormulaC11H23NO3
Molecular Weight217.31 g/mol
Exact Mass217.17
IUPAC Nametert-butyl N-[2-[(2-methylpropan-2-yl)oxy]ethyl]carbamate
SMILESCC(C)(C)OCCNC(=O)OC(C)(C)C
InChIInChI=1S/C11H23NO3/c1-10(2,3)14-8-7-12-9(13)15-11(4,5)6/h7-8H2,1-6H3,(H,12,13)
InChIKeyWONBCUZALBPWES-UHFFFAOYSA-N
XLogP2.33
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.31
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

tert-butyl N-(2-hydroxyethyl)carbamate
CID 2733206
tert-butyl N-(2-hydroxypropyl)carbamate
CID 9920508
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CID 5220470
tert-butyl N-{2-[2-(2-aminoethoxy)ethoxy]ethyl}carbamate
CID 9881394
tert-Butyl (2-(2-(2-(2-aminoethoxy)ethoxy)ethoxy)ethyl)carbamate
CID 10493865
tert-Butyl N-(2-oxiranylmethyl)carbamate
CID 11062891
N-Boc-(S)-1-amino-2-propanol
CID 11789722
tert-Butyl [2-(2-aminoethoxy)ethyl]carbamate
CID 12106198
Tert-butyl (2-(2-(2-hydroxyethoxy)ethoxy)ethyl)carbamate
CID 15742132
tert-butyl N-[2-(2-bromoethoxy)ethyl]carbamate
CID 22712752
(S)-N-Boc-2,3-epoxypropylamine
CID 10080852
tert-butyl N-(2-(2-(2-(2-hydroxyethoxy)ethoxy)ethoxy)ethyl)carbamate
CID 10968359

Frequently Asked Questions

What is the IUPAC name of tert-butyl N-[2-[(2-methylpropan-2-yl)oxy]ethyl]carbamate?
The IUPAC name of tert-butyl N-[2-[(2-methylpropan-2-yl)oxy]ethyl]carbamate (CID 11195314) is tert-butyl N-[2-[(2-methylpropan-2-yl)oxy]ethyl]carbamate.
What is the SMILES notation for tert-butyl N-[2-[(2-methylpropan-2-yl)oxy]ethyl]carbamate?
The canonical SMILES for tert-butyl N-[2-[(2-methylpropan-2-yl)oxy]ethyl]carbamate is CC(C)(C)OCCNC(=O)OC(C)(C)C.
What is the InChIKey of tert-butyl N-[2-[(2-methylpropan-2-yl)oxy]ethyl]carbamate?
The InChIKey is WONBCUZALBPWES-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO3/c1-10(2,3)14-8-7-12-9(13)15-11(4,5)6/h7-8H2,1-6H3,(H,12,13).
What are the key properties of tert-butyl N-[2-[(2-methylpropan-2-yl)oxy]ethyl]carbamate?
tert-butyl N-[2-[(2-methylpropan-2-yl)oxy]ethyl]carbamate has a molecular weight of 217.31 g/mol, XLogP of 2.33, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl N-[2-[(2-methylpropan-2-yl)oxy]ethyl]carbamate is sourced from PubChem (CID 11195314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).