tert-butyl N-[2-(dimethylamino)ethyl]-N-methylcarbamate

C10H22N2O2 — CID 14799455

IUPACtert-butyl N-[2-(dimethylamino)ethyl]-N-methylcarbamate
SMILESCN(C)CCN(C)C(=O)OC(C)(C)C
InChIInChI=1S/C10H22N2O2/c1-10(2,3)14-9(13)12(6)8-7-11(4)5/h7-8H2,1-6H3
InChIKeyZINRTSRXCLRXGZ-UHFFFAOYSA-N
MW202.30 g/mol
LogP1.41
Rot. Bonds3

About tert-butyl N-[2-(dimethylamino)ethyl]-N-methylcarbamate

tert-butyl N-[2-(dimethylamino)ethyl]-N-methylcarbamate (PubChem CID 14799455) has the molecular formula C10H22N2O2 and a molecular weight of 202.30 g/mol. Its IUPAC name is tert-butyl N-[2-(dimethylamino)ethyl]-N-methylcarbamate.

Molecular Properties

Compound Nametert-butyl N-[2-(dimethylamino)ethyl]-N-methylcarbamate
PubChem CID14799455
Molecular FormulaC10H22N2O2
Molecular Weight202.30 g/mol
Exact Mass202.17
IUPAC Nametert-butyl N-[2-(dimethylamino)ethyl]-N-methylcarbamate
SMILESCN(C)CCN(C)C(=O)OC(C)(C)C
InChIInChI=1S/C10H22N2O2/c1-10(2,3)14-9(13)12(6)8-7-11(4)5/h7-8H2,1-6H3
InChIKeyZINRTSRXCLRXGZ-UHFFFAOYSA-N
XLogP1.41
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.30
LogP ≤ 51.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of tert-butyl N-[2-(dimethylamino)ethyl]-N-methylcarbamate?
The IUPAC name of tert-butyl N-[2-(dimethylamino)ethyl]-N-methylcarbamate (CID 14799455) is tert-butyl N-[2-(dimethylamino)ethyl]-N-methylcarbamate.
What is the SMILES notation for tert-butyl N-[2-(dimethylamino)ethyl]-N-methylcarbamate?
The canonical SMILES for tert-butyl N-[2-(dimethylamino)ethyl]-N-methylcarbamate is CN(C)CCN(C)C(=O)OC(C)(C)C.
What is the InChIKey of tert-butyl N-[2-(dimethylamino)ethyl]-N-methylcarbamate?
The InChIKey is ZINRTSRXCLRXGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O2/c1-10(2,3)14-9(13)12(6)8-7-11(4)5/h7-8H2,1-6H3.
What are the key properties of tert-butyl N-[2-(dimethylamino)ethyl]-N-methylcarbamate?
tert-butyl N-[2-(dimethylamino)ethyl]-N-methylcarbamate has a molecular weight of 202.30 g/mol, XLogP of 1.41, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl N-[2-(dimethylamino)ethyl]-N-methylcarbamate is sourced from PubChem (CID 14799455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).