2-morpholin-4-ylethoxycarbonyl 2-morpholin-4-ylethyl carbonate

C14H24N2O7 — CID 143690567

IUPAC2-morpholin-4-ylethoxycarbonyl 2-morpholin-4-ylethyl carbonate
SMILESO=C(OCCN1CCOCC1)OC(=O)OCCN1CCOCC1
InChIInChI=1S/C14H24N2O7/c17-13(21-11-5-15-1-7-19-8-2-15)23-14(18)22-12-6-16-3-9-20-10-4-16/h1-12H2
InChIKeyNJKJNEBGBPYSHN-UHFFFAOYSA-N
MW332.35 g/mol
LogP-0.06
Rot. Bonds6

About 2-morpholin-4-ylethoxycarbonyl 2-morpholin-4-ylethyl carbonate

2-morpholin-4-ylethoxycarbonyl 2-morpholin-4-ylethyl carbonate (PubChem CID 143690567) has the molecular formula C14H24N2O7 and a molecular weight of 332.35 g/mol. Its IUPAC name is 2-morpholin-4-ylethoxycarbonyl 2-morpholin-4-ylethyl carbonate.

Molecular Properties

Compound Name2-morpholin-4-ylethoxycarbonyl 2-morpholin-4-ylethyl carbonate
PubChem CID143690567
Molecular FormulaC14H24N2O7
Molecular Weight332.35 g/mol
Exact Mass332.16
IUPAC Name2-morpholin-4-ylethoxycarbonyl 2-morpholin-4-ylethyl carbonate
SMILESO=C(OCCN1CCOCC1)OC(=O)OCCN1CCOCC1
InChIInChI=1S/C14H24N2O7/c17-13(21-11-5-15-1-7-19-8-2-15)23-14(18)22-12-6-16-3-9-20-10-4-16/h1-12H2
InChIKeyNJKJNEBGBPYSHN-UHFFFAOYSA-N
XLogP-0.06
TPSA86.77 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.35
LogP ≤ 5-0.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}

Analyze 2-morpholin-4-ylethoxycarbonyl 2-morpholin-4-ylethyl carbonate 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-morpholin-4-ylethoxycarbonyl 2-morpholin-4-ylethyl carbonate?
The IUPAC name of 2-morpholin-4-ylethoxycarbonyl 2-morpholin-4-ylethyl carbonate (CID 143690567) is 2-morpholin-4-ylethoxycarbonyl 2-morpholin-4-ylethyl carbonate.
What is the SMILES notation for 2-morpholin-4-ylethoxycarbonyl 2-morpholin-4-ylethyl carbonate?
The canonical SMILES for 2-morpholin-4-ylethoxycarbonyl 2-morpholin-4-ylethyl carbonate is O=C(OCCN1CCOCC1)OC(=O)OCCN1CCOCC1.
What is the InChIKey of 2-morpholin-4-ylethoxycarbonyl 2-morpholin-4-ylethyl carbonate?
The InChIKey is NJKJNEBGBPYSHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O7/c17-13(21-11-5-15-1-7-19-8-2-15)23-14(18)22-12-6-16-3-9-20-10-4-16/h1-12H2.
What are the key properties of 2-morpholin-4-ylethoxycarbonyl 2-morpholin-4-ylethyl carbonate?
2-morpholin-4-ylethoxycarbonyl 2-morpholin-4-ylethyl carbonate has a molecular weight of 332.35 g/mol, XLogP of -0.06, 6 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 2-morpholin-4-ylethoxycarbonyl 2-morpholin-4-ylethyl carbonate is sourced from PubChem (CID 143690567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).