CID 10695390

C22H22N2O2Sn — CID 10695390

IUPAC—
SMILESCCc1ccc2cccc(O)c2n1.CCc1ccc2cccc(O)c2n1.[Sn]
InChIInChI=1S/2C11H11NO.Sn/c2*1-2-9-7-6-8-4-3-5-10(13)11(8)12-9;/h2*3-7,13H,2H2,1H3;
InChIKeyNBCZBQLGBPDRAN-UHFFFAOYSA-N
MW465.14 g/mol
LogP4.62
Rot. Bonds2

About CID 10695390

CID 10695390 (PubChem CID 10695390) has the molecular formula C22H22N2O2Sn and a molecular weight of 465.14 g/mol.

Molecular Properties

Compound NameCID 10695390
PubChem CID10695390
Molecular FormulaC22H22N2O2Sn
Molecular Weight465.14 g/mol
Exact Mass466.07
IUPAC Name—
SMILESCCc1ccc2cccc(O)c2n1.CCc1ccc2cccc(O)c2n1.[Sn]
InChIInChI=1S/2C11H11NO.Sn/c2*1-2-9-7-6-8-4-3-5-10(13)11(8)12-9;/h2*3-7,13H,2H2,1H3;
InChIKeyNBCZBQLGBPDRAN-UHFFFAOYSA-N
XLogP4.62
TPSA66.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500465.14
LogP ≤ 54.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of CID 10695390?
The IUPAC name of CID 10695390 (CID 10695390) is not available.
What is the SMILES notation for CID 10695390?
The canonical SMILES for CID 10695390 is CCc1ccc2cccc(O)c2n1.CCc1ccc2cccc(O)c2n1.[Sn].
What is the InChIKey of CID 10695390?
The InChIKey is NBCZBQLGBPDRAN-UHFFFAOYSA-N. The full InChI is InChI=1S/2C11H11NO.Sn/c2*1-2-9-7-6-8-4-3-5-10(13)11(8)12-9;/h2*3-7,13H,2H2,1H3;.
What are the key properties of CID 10695390?
CID 10695390 has a molecular weight of 465.14 g/mol, XLogP of 4.62, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for CID 10695390 is sourced from PubChem (CID 10695390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).