CID 59101409

C6H13O2Pb — CID 59101409

IUPAC—
SMILESCCC(CO)CCO[Pb]
InChIInChI=1S/C6H13O2.Pb/c1-2-6(5-8)3-4-7;/h6,8H,2-5H2,1H3;/q-1;+1
InChIKeyCJPVKCSLYFBXPO-UHFFFAOYSA-N
MW324.37 g/mol
LogP0.50
Rot. Bonds5

About CID 59101409

CID 59101409 (PubChem CID 59101409) has the molecular formula C6H13O2Pb and a molecular weight of 324.37 g/mol.

Molecular Properties

Compound NameCID 59101409
PubChem CID59101409
Molecular FormulaC6H13O2Pb
Molecular Weight324.37 g/mol
Exact Mass325.07
IUPAC Name—
SMILESCCC(CO)CCO[Pb]
InChIInChI=1S/C6H13O2.Pb/c1-2-6(5-8)3-4-7;/h6,8H,2-5H2,1H3;/q-1;+1
InChIKeyCJPVKCSLYFBXPO-UHFFFAOYSA-N
XLogP0.50
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.37
LogP ≤ 50.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of CID 59101409?
The IUPAC name of CID 59101409 (CID 59101409) is not available.
What is the SMILES notation for CID 59101409?
The canonical SMILES for CID 59101409 is CCC(CO)CCO[Pb].
What is the InChIKey of CID 59101409?
The InChIKey is CJPVKCSLYFBXPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13O2.Pb/c1-2-6(5-8)3-4-7;/h6,8H,2-5H2,1H3;/q-1;+1.
What are the key properties of CID 59101409?
CID 59101409 has a molecular weight of 324.37 g/mol, XLogP of 0.50, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 59101409 is sourced from PubChem (CID 59101409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).