tert-butyl N-cyclopropylcarbamate

C8H15NO2 — CID 15698228

IUPACtert-butyl N-cyclopropylcarbamate
SMILESCC(C)(C)OC(=O)NC1CC1
InChIInChI=1S/C8H15NO2/c1-8(2,3)11-7(10)9-6-4-5-6/h6H,4-5H2,1-3H3,(H,9,10)
InChIKeyWFFGQLYKMWGXMU-UHFFFAOYSA-N
MW157.21 g/mol
LogP1.67
Rot. Bonds1

About tert-butyl N-cyclopropylcarbamate

tert-butyl N-cyclopropylcarbamate (PubChem CID 15698228) has the molecular formula C8H15NO2 and a molecular weight of 157.21 g/mol. Its IUPAC name is tert-butyl N-cyclopropylcarbamate.

Molecular Properties

Compound Nametert-butyl N-cyclopropylcarbamate
PubChem CID15698228
Molecular FormulaC8H15NO2
Molecular Weight157.21 g/mol
Exact Mass157.11
IUPAC Nametert-butyl N-cyclopropylcarbamate
SMILESCC(C)(C)OC(=O)NC1CC1
InChIInChI=1S/C8H15NO2/c1-8(2,3)11-7(10)9-6-4-5-6/h6H,4-5H2,1-3H3,(H,9,10)
InChIKeyWFFGQLYKMWGXMU-UHFFFAOYSA-N
XLogP1.67
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.21
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of tert-butyl N-cyclopropylcarbamate?
The IUPAC name of tert-butyl N-cyclopropylcarbamate (CID 15698228) is tert-butyl N-cyclopropylcarbamate.
What is the SMILES notation for tert-butyl N-cyclopropylcarbamate?
The canonical SMILES for tert-butyl N-cyclopropylcarbamate is CC(C)(C)OC(=O)NC1CC1.
What is the InChIKey of tert-butyl N-cyclopropylcarbamate?
The InChIKey is WFFGQLYKMWGXMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO2/c1-8(2,3)11-7(10)9-6-4-5-6/h6H,4-5H2,1-3H3,(H,9,10).
What are the key properties of tert-butyl N-cyclopropylcarbamate?
tert-butyl N-cyclopropylcarbamate has a molecular weight of 157.21 g/mol, XLogP of 1.67, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl N-cyclopropylcarbamate is sourced from PubChem (CID 15698228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).