tert-butyl N-(2-aminoethyl)-N-cyclopropylcarbamate

C10H20N2O2 — CID 50986373

IUPACtert-butyl N-(2-aminoethyl)-N-cyclopropylcarbamate
SMILESCC(C)(C)OC(=O)N(CCN)C1CC1
InChIInChI=1S/C10H20N2O2/c1-10(2,3)14-9(13)12(7-6-11)8-4-5-8/h8H,4-7,11H2,1-3H3
InChIKeyVTPMKZZRRCKGMQ-UHFFFAOYSA-N
MW200.28 g/mol
LogP1.34
Rot. Bonds3

About tert-butyl N-(2-aminoethyl)-N-cyclopropylcarbamate

tert-butyl N-(2-aminoethyl)-N-cyclopropylcarbamate (PubChem CID 50986373) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is tert-butyl N-(2-aminoethyl)-N-cyclopropylcarbamate.

Molecular Properties

Compound Nametert-butyl N-(2-aminoethyl)-N-cyclopropylcarbamate
PubChem CID50986373
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC Nametert-butyl N-(2-aminoethyl)-N-cyclopropylcarbamate
SMILESCC(C)(C)OC(=O)N(CCN)C1CC1
InChIInChI=1S/C10H20N2O2/c1-10(2,3)14-9(13)12(7-6-11)8-4-5-8/h8H,4-7,11H2,1-3H3
InChIKeyVTPMKZZRRCKGMQ-UHFFFAOYSA-N
XLogP1.34
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of tert-butyl N-(2-aminoethyl)-N-cyclopropylcarbamate?
The IUPAC name of tert-butyl N-(2-aminoethyl)-N-cyclopropylcarbamate (CID 50986373) is tert-butyl N-(2-aminoethyl)-N-cyclopropylcarbamate.
What is the SMILES notation for tert-butyl N-(2-aminoethyl)-N-cyclopropylcarbamate?
The canonical SMILES for tert-butyl N-(2-aminoethyl)-N-cyclopropylcarbamate is CC(C)(C)OC(=O)N(CCN)C1CC1.
What is the InChIKey of tert-butyl N-(2-aminoethyl)-N-cyclopropylcarbamate?
The InChIKey is VTPMKZZRRCKGMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2/c1-10(2,3)14-9(13)12(7-6-11)8-4-5-8/h8H,4-7,11H2,1-3H3.
What are the key properties of tert-butyl N-(2-aminoethyl)-N-cyclopropylcarbamate?
tert-butyl N-(2-aminoethyl)-N-cyclopropylcarbamate has a molecular weight of 200.28 g/mol, XLogP of 1.34, 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-aminoethyl)-N-cyclopropylcarbamate is sourced from PubChem (CID 50986373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).