tert-butyl N-[2-[2-hydroxyethyl(methyl)amino]ethyl]carbamate

C10H22N2O3 — CID 15933188

IUPACtert-butyl N-[2-[2-hydroxyethyl(methyl)amino]ethyl]carbamate
SMILESCN(CCO)CCNC(=O)OC(C)(C)C
InChIInChI=1S/C10H22N2O3/c1-10(2,3)15-9(14)11-5-6-12(4)7-8-13/h13H,5-8H2,1-4H3,(H,11,14)
InChIKeyBYIPIBLHBIMKQQ-UHFFFAOYSA-N
MW218.30 g/mol
LogP0.44
Rot. Bonds5

About tert-butyl N-[2-[2-hydroxyethyl(methyl)amino]ethyl]carbamate

tert-butyl N-[2-[2-hydroxyethyl(methyl)amino]ethyl]carbamate (PubChem CID 15933188) has the molecular formula C10H22N2O3 and a molecular weight of 218.30 g/mol. Its IUPAC name is tert-butyl N-[2-[2-hydroxyethyl(methyl)amino]ethyl]carbamate.

Molecular Properties

Compound Nametert-butyl N-[2-[2-hydroxyethyl(methyl)amino]ethyl]carbamate
PubChem CID15933188
Molecular FormulaC10H22N2O3
Molecular Weight218.30 g/mol
Exact Mass218.16
IUPAC Nametert-butyl N-[2-[2-hydroxyethyl(methyl)amino]ethyl]carbamate
SMILESCN(CCO)CCNC(=O)OC(C)(C)C
InChIInChI=1S/C10H22N2O3/c1-10(2,3)15-9(14)11-5-6-12(4)7-8-13/h13H,5-8H2,1-4H3,(H,11,14)
InChIKeyBYIPIBLHBIMKQQ-UHFFFAOYSA-N
XLogP0.44
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.30
LogP ≤ 50.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of tert-butyl N-[2-[2-hydroxyethyl(methyl)amino]ethyl]carbamate?
The IUPAC name of tert-butyl N-[2-[2-hydroxyethyl(methyl)amino]ethyl]carbamate (CID 15933188) is tert-butyl N-[2-[2-hydroxyethyl(methyl)amino]ethyl]carbamate.
What is the SMILES notation for tert-butyl N-[2-[2-hydroxyethyl(methyl)amino]ethyl]carbamate?
The canonical SMILES for tert-butyl N-[2-[2-hydroxyethyl(methyl)amino]ethyl]carbamate is CN(CCO)CCNC(=O)OC(C)(C)C.
What is the InChIKey of tert-butyl N-[2-[2-hydroxyethyl(methyl)amino]ethyl]carbamate?
The InChIKey is BYIPIBLHBIMKQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O3/c1-10(2,3)15-9(14)11-5-6-12(4)7-8-13/h13H,5-8H2,1-4H3,(H,11,14).
What are the key properties of tert-butyl N-[2-[2-hydroxyethyl(methyl)amino]ethyl]carbamate?
tert-butyl N-[2-[2-hydroxyethyl(methyl)amino]ethyl]carbamate has a molecular weight of 218.30 g/mol, XLogP of 0.44, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl N-[2-[2-hydroxyethyl(methyl)amino]ethyl]carbamate is sourced from PubChem (CID 15933188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).