CID 59269786

C9H14O2 — CID 59269786

IUPAC—
SMILES[CH]C1CCC2(CC1)OCCO2
InChIInChI=1S/C9H14O2/c1-8-2-4-9(5-3-8)10-6-7-11-9/h1,8H,2-7H2
InChIKeyJDNCFTWWLJHARV-UHFFFAOYSA-N
MW154.21 g/mol
LogP1.63
Rot. Bonds

About CID 59269786

CID 59269786 (PubChem CID 59269786) has the molecular formula C9H14O2 and a molecular weight of 154.21 g/mol.

Molecular Properties

Compound NameCID 59269786
PubChem CID59269786
Molecular FormulaC9H14O2
Molecular Weight154.21 g/mol
Exact Mass154.10
IUPAC Name—
SMILES[CH]C1CCC2(CC1)OCCO2
InChIInChI=1S/C9H14O2/c1-8-2-4-9(5-3-8)10-6-7-11-9/h1,8H,2-7H2
InChIKeyJDNCFTWWLJHARV-UHFFFAOYSA-N
XLogP1.63
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
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 59269786?
The IUPAC name of CID 59269786 (CID 59269786) is not available.
What is the SMILES notation for CID 59269786?
The canonical SMILES for CID 59269786 is [CH]C1CCC2(CC1)OCCO2.
What is the InChIKey of CID 59269786?
The InChIKey is JDNCFTWWLJHARV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14O2/c1-8-2-4-9(5-3-8)10-6-7-11-9/h1,8H,2-7H2.
What are the key properties of CID 59269786?
CID 59269786 has a molecular weight of 154.21 g/mol, XLogP of 1.63, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 59269786 is sourced from PubChem (CID 59269786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).