CID 160765795

C20H37NNaOSn — CID 160765795

IUPAC—
SMILESCCCC[Sn](CCCC)(CCCC)c1cccc(OC(C)C)n1.[Na]
InChIInChI=1S/C8H10NO.3C4H9.Na.Sn/c1-7(2)10-8-5-3-4-6-9-8;3*1-3-4-2;;/h3-5,7H,1-2H3;3*1,3-4H2,2H3;;
InChIKeyRYQZPMRKHJMDFD-UHFFFAOYSA-N
MW449.22 g/mol
LogP5.54
Rot. Bonds12

About CID 160765795

CID 160765795 (PubChem CID 160765795) has the molecular formula C20H37NNaOSn and a molecular weight of 449.22 g/mol.

Molecular Properties

Compound NameCID 160765795
PubChem CID160765795
Molecular FormulaC20H37NNaOSn
Molecular Weight449.22 g/mol
Exact Mass450.18
IUPAC Name—
SMILESCCCC[Sn](CCCC)(CCCC)c1cccc(OC(C)C)n1.[Na]
InChIInChI=1S/C8H10NO.3C4H9.Na.Sn/c1-7(2)10-8-5-3-4-6-9-8;3*1-3-4-2;;/h3-5,7H,1-2H3;3*1,3-4H2,2H3;;
InChIKeyRYQZPMRKHJMDFD-UHFFFAOYSA-N
XLogP5.54
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds12
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500449.22
LogP ≤ 55.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-Ethoxypyridine
CID 84499
2,6-Bis(2-(dimethylamino)ethoxy)pyridine
CID 96392
2-Chloro-6-ethoxypyridine
CID 98563
Allyl 2-pyridyl ether
CID 79906
2,6-Dimethoxypyridine
CID 80378
Butyl 2-pyridyl ether
CID 95701
2-(Dodecyloxy)pyridine
CID 96440
2,6-Diphenoxypyridine
CID 824772
2-Methoxy-6-(tributylstannyl)pyridine
CID 10524891
2-tert-Butoxy-6-chloropyridine
CID 11984350
2-Iodo-6-methoxypyridine
CID 17750201
2-Bromo-6-tert-butoxypyridine
CID 29919811

Frequently Asked Questions

What is the IUPAC name of CID 160765795?
The IUPAC name of CID 160765795 (CID 160765795) is not available.
What is the SMILES notation for CID 160765795?
The canonical SMILES for CID 160765795 is CCCC[Sn](CCCC)(CCCC)c1cccc(OC(C)C)n1.[Na].
What is the InChIKey of CID 160765795?
The InChIKey is RYQZPMRKHJMDFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10NO.3C4H9.Na.Sn/c1-7(2)10-8-5-3-4-6-9-8;3*1-3-4-2;;/h3-5,7H,1-2H3;3*1,3-4H2,2H3;;.
What are the key properties of CID 160765795?
CID 160765795 has a molecular weight of 449.22 g/mol, XLogP of 5.54, 12 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 160765795 is sourced from PubChem (CID 160765795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).