5-butylnonan-5-yl(1,2-oxazol-5-yl)tin

C16H29NOSn — CID 141218292

IUPAC5-butylnonan-5-yl(1,2-oxazol-5-yl)tin
SMILESCCCCC(CCCC)(CCCC)[Sn]c1ccno1
InChIInChI=1S/C13H27.C3H2NO.Sn/c1-4-7-10-13(11-8-5-2)12-9-6-3;1-2-4-5-3-1;/h4-12H2,1-3H3;1-2H;
InChIKeyWWCQHKLSRNBETJ-UHFFFAOYSA-N
MW370.13 g/mol
LogP4.73
Rot. Bonds11

About 5-butylnonan-5-yl(1,2-oxazol-5-yl)tin

5-butylnonan-5-yl(1,2-oxazol-5-yl)tin (PubChem CID 141218292) has the molecular formula C16H29NOSn and a molecular weight of 370.13 g/mol. Its IUPAC name is 5-butylnonan-5-yl(1,2-oxazol-5-yl)tin.

Molecular Properties

Compound Name5-butylnonan-5-yl(1,2-oxazol-5-yl)tin
PubChem CID141218292
Molecular FormulaC16H29NOSn
Molecular Weight370.13 g/mol
Exact Mass371.13
IUPAC Name5-butylnonan-5-yl(1,2-oxazol-5-yl)tin
SMILESCCCCC(CCCC)(CCCC)[Sn]c1ccno1
InChIInChI=1S/C13H27.C3H2NO.Sn/c1-4-7-10-13(11-8-5-2)12-9-6-3;1-2-4-5-3-1;/h4-12H2,1-3H3;1-2H;
InChIKeyWWCQHKLSRNBETJ-UHFFFAOYSA-N
XLogP4.73
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.13
LogP ≤ 54.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-butylnonan-5-yl(1,2-oxazol-5-yl)tin?
The IUPAC name of 5-butylnonan-5-yl(1,2-oxazol-5-yl)tin (CID 141218292) is 5-butylnonan-5-yl(1,2-oxazol-5-yl)tin.
What is the SMILES notation for 5-butylnonan-5-yl(1,2-oxazol-5-yl)tin?
The canonical SMILES for 5-butylnonan-5-yl(1,2-oxazol-5-yl)tin is CCCCC(CCCC)(CCCC)[Sn]c1ccno1.
What is the InChIKey of 5-butylnonan-5-yl(1,2-oxazol-5-yl)tin?
The InChIKey is WWCQHKLSRNBETJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27.C3H2NO.Sn/c1-4-7-10-13(11-8-5-2)12-9-6-3;1-2-4-5-3-1;/h4-12H2,1-3H3;1-2H;.
What are the key properties of 5-butylnonan-5-yl(1,2-oxazol-5-yl)tin?
5-butylnonan-5-yl(1,2-oxazol-5-yl)tin has a molecular weight of 370.13 g/mol, XLogP of 4.73, 11 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-butylnonan-5-yl(1,2-oxazol-5-yl)tin is sourced from PubChem (CID 141218292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).