CID 59269723

C9H14O2 — CID 59269723

IUPAC—
SMILES[CH]C(C)C1COC2(CCC2)O1
InChIInChI=1S/C9H14O2/c1-7(2)8-6-10-9(11-8)4-3-5-9/h1,7-8H,3-6H2,2H3
InChIKeyMWBXLQMSDOFRSE-UHFFFAOYSA-N
MW154.21 g/mol
LogP1.63
Rot. Bonds1

About CID 59269723

CID 59269723 (PubChem CID 59269723) has the molecular formula C9H14O2 and a molecular weight of 154.21 g/mol.

Molecular Properties

Compound NameCID 59269723
PubChem CID59269723
Molecular FormulaC9H14O2
Molecular Weight154.21 g/mol
Exact Mass154.10
IUPAC Name—
SMILES[CH]C(C)C1COC2(CCC2)O1
InChIInChI=1S/C9H14O2/c1-7(2)8-6-10-9(11-8)4-3-5-9/h1,7-8H,3-6H2,2H3
InChIKeyMWBXLQMSDOFRSE-UHFFFAOYSA-N
XLogP1.63
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.21
LogP ≤ 51.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of CID 59269723?
The IUPAC name of CID 59269723 (CID 59269723) is not available.
What is the SMILES notation for CID 59269723?
The canonical SMILES for CID 59269723 is [CH]C(C)C1COC2(CCC2)O1.
What is the InChIKey of CID 59269723?
The InChIKey is MWBXLQMSDOFRSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14O2/c1-7(2)8-6-10-9(11-8)4-3-5-9/h1,7-8H,3-6H2,2H3.
What are the key properties of CID 59269723?
CID 59269723 has a molecular weight of 154.21 g/mol, XLogP of 1.63, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 59269723 is sourced from PubChem (CID 59269723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).