[2-methoxy-3-(propan-2-ylcarbamoyloxy)propyl] N-propan-2-ylcarbamate

C12H24N2O5 — CID 88562623

IUPAC[2-methoxy-3-(propan-2-ylcarbamoyloxy)propyl] N-propan-2-ylcarbamate
SMILESCOC(COC(=O)NC(C)C)COC(=O)NC(C)C
InChIInChI=1S/C12H24N2O5/c1-8(2)13-11(15)18-6-10(17-5)7-19-12(16)14-9(3)4/h8-10H,6-7H2,1-5H3,(H,13,15)(H,14,16)
InChIKeyBSKVGPWEOQBJBR-UHFFFAOYSA-N
MW276.33 g/mol
LogP1.27
Rot. Bonds7

About [2-methoxy-3-(propan-2-ylcarbamoyloxy)propyl] N-propan-2-ylcarbamate

[2-methoxy-3-(propan-2-ylcarbamoyloxy)propyl] N-propan-2-ylcarbamate (PubChem CID 88562623) has the molecular formula C12H24N2O5 and a molecular weight of 276.33 g/mol. Its IUPAC name is [2-methoxy-3-(propan-2-ylcarbamoyloxy)propyl] N-propan-2-ylcarbamate.

Molecular Properties

Compound Name[2-methoxy-3-(propan-2-ylcarbamoyloxy)propyl] N-propan-2-ylcarbamate
PubChem CID88562623
Molecular FormulaC12H24N2O5
Molecular Weight276.33 g/mol
Exact Mass276.17
IUPAC Name[2-methoxy-3-(propan-2-ylcarbamoyloxy)propyl] N-propan-2-ylcarbamate
SMILESCOC(COC(=O)NC(C)C)COC(=O)NC(C)C
InChIInChI=1S/C12H24N2O5/c1-8(2)13-11(15)18-6-10(17-5)7-19-12(16)14-9(3)4/h8-10H,6-7H2,1-5H3,(H,13,15)(H,14,16)
InChIKeyBSKVGPWEOQBJBR-UHFFFAOYSA-N
XLogP1.27
TPSA85.89 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.33
LogP ≤ 51.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze [2-methoxy-3-(propan-2-ylcarbamoyloxy)propyl] N-propan-2-ylcarbamate 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 [2-methoxy-3-(propan-2-ylcarbamoyloxy)propyl] N-propan-2-ylcarbamate?
The IUPAC name of [2-methoxy-3-(propan-2-ylcarbamoyloxy)propyl] N-propan-2-ylcarbamate (CID 88562623) is [2-methoxy-3-(propan-2-ylcarbamoyloxy)propyl] N-propan-2-ylcarbamate.
What is the SMILES notation for [2-methoxy-3-(propan-2-ylcarbamoyloxy)propyl] N-propan-2-ylcarbamate?
The canonical SMILES for [2-methoxy-3-(propan-2-ylcarbamoyloxy)propyl] N-propan-2-ylcarbamate is COC(COC(=O)NC(C)C)COC(=O)NC(C)C.
What is the InChIKey of [2-methoxy-3-(propan-2-ylcarbamoyloxy)propyl] N-propan-2-ylcarbamate?
The InChIKey is BSKVGPWEOQBJBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O5/c1-8(2)13-11(15)18-6-10(17-5)7-19-12(16)14-9(3)4/h8-10H,6-7H2,1-5H3,(H,13,15)(H,14,16).
What are the key properties of [2-methoxy-3-(propan-2-ylcarbamoyloxy)propyl] N-propan-2-ylcarbamate?
[2-methoxy-3-(propan-2-ylcarbamoyloxy)propyl] N-propan-2-ylcarbamate has a molecular weight of 276.33 g/mol, XLogP of 1.27, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-methoxy-3-(propan-2-ylcarbamoyloxy)propyl] N-propan-2-ylcarbamate is sourced from PubChem (CID 88562623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).