cobalt;cyclooctane;pentane

C13H28Co — CID 57373062

IUPACcobalt;cyclooctane;pentane
SMILESC1CCCCCCC1.CCCCC.[Co]
InChIInChI=1S/C8H16.C5H12.Co/c1-2-4-6-8-7-5-3-1;1-3-5-4-2;/h1-8H2;3-5H2,1-2H3;
InChIKeyOLHTUYQRDAJDBQ-UHFFFAOYSA-N
MW243.30 g/mol
LogP5.31
Rot. Bonds2

About cobalt;cyclooctane;pentane

cobalt;cyclooctane;pentane (PubChem CID 57373062) has the molecular formula C13H28Co and a molecular weight of 243.30 g/mol. Its IUPAC name is cobalt;cyclooctane;pentane.

Molecular Properties

Compound Namecobalt;cyclooctane;pentane
PubChem CID57373062
Molecular FormulaC13H28Co
Molecular Weight243.30 g/mol
Exact Mass243.15
IUPAC Namecobalt;cyclooctane;pentane
SMILESC1CCCCCCC1.CCCCC.[Co]
InChIInChI=1S/C8H16.C5H12.Co/c1-2-4-6-8-7-5-3-1;1-3-5-4-2;/h1-8H2;3-5H2,1-2H3;
InChIKeyOLHTUYQRDAJDBQ-UHFFFAOYSA-N
XLogP5.31
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500243.30
LogP ≤ 55.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of cobalt;cyclooctane;pentane?
The IUPAC name of cobalt;cyclooctane;pentane (CID 57373062) is cobalt;cyclooctane;pentane.
What is the SMILES notation for cobalt;cyclooctane;pentane?
The canonical SMILES for cobalt;cyclooctane;pentane is C1CCCCCCC1.CCCCC.[Co].
What is the InChIKey of cobalt;cyclooctane;pentane?
The InChIKey is OLHTUYQRDAJDBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16.C5H12.Co/c1-2-4-6-8-7-5-3-1;1-3-5-4-2;/h1-8H2;3-5H2,1-2H3;.
What are the key properties of cobalt;cyclooctane;pentane?
cobalt;cyclooctane;pentane has a molecular weight of 243.30 g/mol, XLogP of 5.31, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for cobalt;cyclooctane;pentane is sourced from PubChem (CID 57373062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).