CID 59971181

C10H18NO3Sn — CID 59971181

IUPAC—
SMILESCC(=O)OC1CCN(C)CC1C(O)C[Sn]
InChIInChI=1S/C10H18NO3.Sn/c1-7(12)9-6-11(3)5-4-10(9)14-8(2)13;/h7,9-10,12H,1,4-6H2,2-3H3;
InChIKeyZTMJCSRFCYAGCT-UHFFFAOYSA-N
MW318.97 g/mol
LogP-0.18
Rot. Bonds3

About CID 59971181

CID 59971181 (PubChem CID 59971181) has the molecular formula C10H18NO3Sn and a molecular weight of 318.97 g/mol.

Molecular Properties

Compound NameCID 59971181
PubChem CID59971181
Molecular FormulaC10H18NO3Sn
Molecular Weight318.97 g/mol
Exact Mass320.03
IUPAC Name—
SMILESCC(=O)OC1CCN(C)CC1C(O)C[Sn]
InChIInChI=1S/C10H18NO3.Sn/c1-7(12)9-6-11(3)5-4-10(9)14-8(2)13;/h7,9-10,12H,1,4-6H2,2-3H3;
InChIKeyZTMJCSRFCYAGCT-UHFFFAOYSA-N
XLogP-0.18
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.97
LogP ≤ 5-0.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of CID 59971181?
The IUPAC name of CID 59971181 (CID 59971181) is not available.
What is the SMILES notation for CID 59971181?
The canonical SMILES for CID 59971181 is CC(=O)OC1CCN(C)CC1C(O)C[Sn].
What is the InChIKey of CID 59971181?
The InChIKey is ZTMJCSRFCYAGCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18NO3.Sn/c1-7(12)9-6-11(3)5-4-10(9)14-8(2)13;/h7,9-10,12H,1,4-6H2,2-3H3;.
What are the key properties of CID 59971181?
CID 59971181 has a molecular weight of 318.97 g/mol, XLogP of -0.18, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for CID 59971181 is sourced from PubChem (CID 59971181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).