CID 70405773

C12H22MgN2O2 — CID 70405773

IUPAC—
SMILESO=C1CCCCCN1.O=C1CCCCCN1.[Mg]
InChIInChI=1S/2C6H11NO.Mg/c2*8-6-4-2-1-3-5-7-6;/h2*1-5H2,(H,7,8);
InChIKeyABMPLDRTDDMKHF-UHFFFAOYSA-N
MW250.62 g/mol
LogP0.97
Rot. Bonds

About CID 70405773

CID 70405773 (PubChem CID 70405773) has the molecular formula C12H22MgN2O2 and a molecular weight of 250.62 g/mol.

Molecular Properties

Compound NameCID 70405773
PubChem CID70405773
Molecular FormulaC12H22MgN2O2
Molecular Weight250.62 g/mol
Exact Mass250.15
IUPAC Name—
SMILESO=C1CCCCCN1.O=C1CCCCCN1.[Mg]
InChIInChI=1S/2C6H11NO.Mg/c2*8-6-4-2-1-3-5-7-6;/h2*1-5H2,(H,7,8);
InChIKeyABMPLDRTDDMKHF-UHFFFAOYSA-N
XLogP0.97
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.62
LogP ≤ 50.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of CID 70405773?
The IUPAC name of CID 70405773 (CID 70405773) is not available.
What is the SMILES notation for CID 70405773?
The canonical SMILES for CID 70405773 is O=C1CCCCCN1.O=C1CCCCCN1.[Mg].
What is the InChIKey of CID 70405773?
The InChIKey is ABMPLDRTDDMKHF-UHFFFAOYSA-N. The full InChI is InChI=1S/2C6H11NO.Mg/c2*8-6-4-2-1-3-5-7-6;/h2*1-5H2,(H,7,8);.
What are the key properties of CID 70405773?
CID 70405773 has a molecular weight of 250.62 g/mol, XLogP of 0.97, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 70405773 is sourced from PubChem (CID 70405773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).