CID 59269063

C11H18O2 — CID 59269063

IUPAC—
SMILES[CH]CCC1COC2(CCCCC2)O1
InChIInChI=1S/C11H18O2/c1-2-6-10-9-12-11(13-10)7-4-3-5-8-11/h1,10H,2-9H2
InChIKeyVSBCKKYALPERBS-UHFFFAOYSA-N
MW182.26 g/mol
LogP2.55
Rot. Bonds2

About CID 59269063

CID 59269063 (PubChem CID 59269063) has the molecular formula C11H18O2 and a molecular weight of 182.26 g/mol.

Molecular Properties

Compound NameCID 59269063
PubChem CID59269063
Molecular FormulaC11H18O2
Molecular Weight182.26 g/mol
Exact Mass182.13
IUPAC Name—
SMILES[CH]CCC1COC2(CCCCC2)O1
InChIInChI=1S/C11H18O2/c1-2-6-10-9-12-11(13-10)7-4-3-5-8-11/h1,10H,2-9H2
InChIKeyVSBCKKYALPERBS-UHFFFAOYSA-N
XLogP2.55
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.26
LogP ≤ 52.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of CID 59269063?
The IUPAC name of CID 59269063 (CID 59269063) is not available.
What is the SMILES notation for CID 59269063?
The canonical SMILES for CID 59269063 is [CH]CCC1COC2(CCCCC2)O1.
What is the InChIKey of CID 59269063?
The InChIKey is VSBCKKYALPERBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18O2/c1-2-6-10-9-12-11(13-10)7-4-3-5-8-11/h1,10H,2-9H2.
What are the key properties of CID 59269063?
CID 59269063 has a molecular weight of 182.26 g/mol, XLogP of 2.55, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 59269063 is sourced from PubChem (CID 59269063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).