CID 173318414

C13H28NSn — CID 173318414

IUPAC—
SMILESC#N.CC(C)C[Sn](CC(C)C)CC(C)C
InChIInChI=1S/3C4H9.CHN.Sn/c3*1-4(2)3;1-2;/h3*4H,1H2,2-3H3;1H;
InChIKeyWXLILDBWDKZCRV-UHFFFAOYSA-N
MW317.09 g/mol
LogP4.59
Rot. Bonds6

About CID 173318414

CID 173318414 (PubChem CID 173318414) has the molecular formula C13H28NSn and a molecular weight of 317.09 g/mol.

Molecular Properties

Compound NameCID 173318414
PubChem CID173318414
Molecular FormulaC13H28NSn
Molecular Weight317.09 g/mol
Exact Mass318.12
IUPAC Name—
SMILESC#N.CC(C)C[Sn](CC(C)C)CC(C)C
InChIInChI=1S/3C4H9.CHN.Sn/c3*1-4(2)3;1-2;/h3*4H,1H2,2-3H3;1H;
InChIKeyWXLILDBWDKZCRV-UHFFFAOYSA-N
XLogP4.59
TPSA23.79 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.09
LogP ≤ 54.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of CID 173318414?
The IUPAC name of CID 173318414 (CID 173318414) is not available.
What is the SMILES notation for CID 173318414?
The canonical SMILES for CID 173318414 is C#N.CC(C)C[Sn](CC(C)C)CC(C)C.
What is the InChIKey of CID 173318414?
The InChIKey is WXLILDBWDKZCRV-UHFFFAOYSA-N. The full InChI is InChI=1S/3C4H9.CHN.Sn/c3*1-4(2)3;1-2;/h3*4H,1H2,2-3H3;1H;.
What are the key properties of CID 173318414?
CID 173318414 has a molecular weight of 317.09 g/mol, XLogP of 4.59, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 173318414 is sourced from PubChem (CID 173318414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).