tert-butyl N-methyl-N-(oxolan-2-ylmethyl)carbamate

C11H21NO3 — CID 65142791

IUPACtert-butyl N-methyl-N-(oxolan-2-ylmethyl)carbamate
SMILESCN(CC1CCCO1)C(=O)OC(C)(C)C
InChIInChI=1S/C11H21NO3/c1-11(2,3)15-10(13)12(4)8-9-6-5-7-14-9/h9H,5-8H2,1-4H3
InChIKeyYMTJLZJVYSMPQV-UHFFFAOYSA-N
MW215.29 g/mol
LogP2.03
Rot. Bonds2

About tert-butyl N-methyl-N-(oxolan-2-ylmethyl)carbamate

tert-butyl N-methyl-N-(oxolan-2-ylmethyl)carbamate (PubChem CID 65142791) has the molecular formula C11H21NO3 and a molecular weight of 215.29 g/mol. Its IUPAC name is tert-butyl N-methyl-N-(oxolan-2-ylmethyl)carbamate.

Molecular Properties

Compound Nametert-butyl N-methyl-N-(oxolan-2-ylmethyl)carbamate
PubChem CID65142791
Molecular FormulaC11H21NO3
Molecular Weight215.29 g/mol
Exact Mass215.15
IUPAC Nametert-butyl N-methyl-N-(oxolan-2-ylmethyl)carbamate
SMILESCN(CC1CCCO1)C(=O)OC(C)(C)C
InChIInChI=1S/C11H21NO3/c1-11(2,3)15-10(13)12(4)8-9-6-5-7-14-9/h9H,5-8H2,1-4H3
InChIKeyYMTJLZJVYSMPQV-UHFFFAOYSA-N
XLogP2.03
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.29
LogP ≤ 52.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze tert-butyl N-methyl-N-(oxolan-2-ylmethyl)carbamate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of tert-butyl N-methyl-N-(oxolan-2-ylmethyl)carbamate?
The IUPAC name of tert-butyl N-methyl-N-(oxolan-2-ylmethyl)carbamate (CID 65142791) is tert-butyl N-methyl-N-(oxolan-2-ylmethyl)carbamate.
What is the SMILES notation for tert-butyl N-methyl-N-(oxolan-2-ylmethyl)carbamate?
The canonical SMILES for tert-butyl N-methyl-N-(oxolan-2-ylmethyl)carbamate is CN(CC1CCCO1)C(=O)OC(C)(C)C.
What is the InChIKey of tert-butyl N-methyl-N-(oxolan-2-ylmethyl)carbamate?
The InChIKey is YMTJLZJVYSMPQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO3/c1-11(2,3)15-10(13)12(4)8-9-6-5-7-14-9/h9H,5-8H2,1-4H3.
What are the key properties of tert-butyl N-methyl-N-(oxolan-2-ylmethyl)carbamate?
tert-butyl N-methyl-N-(oxolan-2-ylmethyl)carbamate has a molecular weight of 215.29 g/mol, XLogP of 2.03, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl N-methyl-N-(oxolan-2-ylmethyl)carbamate is sourced from PubChem (CID 65142791), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).