tert-butyl N-(2-aminoethyl)-N-(2-methoxyethyl)carbamate

C10H22N2O3 — CID 71757560

IUPACtert-butyl N-(2-aminoethyl)-N-(2-methoxyethyl)carbamate
SMILESCOCCN(CCN)C(=O)OC(C)(C)C
InChIInChI=1S/C10H22N2O3/c1-10(2,3)15-9(13)12(6-5-11)7-8-14-4/h5-8,11H2,1-4H3
InChIKeyPYMFLTAVZIIVNN-UHFFFAOYSA-N
MW218.30 g/mol
LogP0.83
Rot. Bonds5

About tert-butyl N-(2-aminoethyl)-N-(2-methoxyethyl)carbamate

tert-butyl N-(2-aminoethyl)-N-(2-methoxyethyl)carbamate (PubChem CID 71757560) has the molecular formula C10H22N2O3 and a molecular weight of 218.30 g/mol. Its IUPAC name is tert-butyl N-(2-aminoethyl)-N-(2-methoxyethyl)carbamate.

Molecular Properties

Compound Nametert-butyl N-(2-aminoethyl)-N-(2-methoxyethyl)carbamate
PubChem CID71757560
Molecular FormulaC10H22N2O3
Molecular Weight218.30 g/mol
Exact Mass218.16
IUPAC Nametert-butyl N-(2-aminoethyl)-N-(2-methoxyethyl)carbamate
SMILESCOCCN(CCN)C(=O)OC(C)(C)C
InChIInChI=1S/C10H22N2O3/c1-10(2,3)15-9(13)12(6-5-11)7-8-14-4/h5-8,11H2,1-4H3
InChIKeyPYMFLTAVZIIVNN-UHFFFAOYSA-N
XLogP0.83
TPSA64.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.30
LogP ≤ 50.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-Boc-N-methylethylenediamine
CID 2756424
tert-Butyl [2-(2-aminoethoxy)ethyl]carbamate
CID 12106198
tert-Butyl methyl(2-(methylamino)ethyl)carbamate
CID 14403871
tert-butyl N-(2-aminoethyl)-N-propylcarbamate
CID 14925148
tert-butyl N-((2R)-1-aminopropan-2-yl)-N-ethylcarbamate
CID 91647492
tert-butyl N-{2-[(2-hydroxyethyl)amino]ethyl}carbamate
CID 10932586
1,1-Dimethylethyl N,N-bis(2-aminoethyl)carbamate
CID 12066943
tert-butyl N-(2-aminoethyl)-N-ethylcarbamate
CID 14139168
tert-butyl N-(2-((2-hydroxyethyl)(methyl)amino)ethyl)carbamate
CID 15933188
tert-butyl N-(2-{[2-(morpholin-4-yl)ethyl]amino}ethyl)carbamate
CID 19420463
Tert-butyl 4-(2-(2-aminoethoxy)ethyl)piperazine-1-carboxylate
CID 39372804
3-Aminomethyl-4-boc-morpholine
CID 44182325

Frequently Asked Questions

What is the IUPAC name of tert-butyl N-(2-aminoethyl)-N-(2-methoxyethyl)carbamate?
The IUPAC name of tert-butyl N-(2-aminoethyl)-N-(2-methoxyethyl)carbamate (CID 71757560) is tert-butyl N-(2-aminoethyl)-N-(2-methoxyethyl)carbamate.
What is the SMILES notation for tert-butyl N-(2-aminoethyl)-N-(2-methoxyethyl)carbamate?
The canonical SMILES for tert-butyl N-(2-aminoethyl)-N-(2-methoxyethyl)carbamate is COCCN(CCN)C(=O)OC(C)(C)C.
What is the InChIKey of tert-butyl N-(2-aminoethyl)-N-(2-methoxyethyl)carbamate?
The InChIKey is PYMFLTAVZIIVNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O3/c1-10(2,3)15-9(13)12(6-5-11)7-8-14-4/h5-8,11H2,1-4H3.
What are the key properties of tert-butyl N-(2-aminoethyl)-N-(2-methoxyethyl)carbamate?
tert-butyl N-(2-aminoethyl)-N-(2-methoxyethyl)carbamate has a molecular weight of 218.30 g/mol, XLogP of 0.83, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl N-(2-aminoethyl)-N-(2-methoxyethyl)carbamate is sourced from PubChem (CID 71757560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).