CID 59269076

C10H18O2 — CID 59269076

IUPAC—
SMILES[CH]CCC1COC(CCC)OC1
InChIInChI=1S/C10H18O2/c1-3-5-9-7-11-10(6-4-2)12-8-9/h1,9-10H,3-8H2,2H3
InChIKeyFQXGTSZHZIVCOQ-UHFFFAOYSA-N
MW170.25 g/mol
LogP2.27
Rot. Bonds4

About CID 59269076

CID 59269076 (PubChem CID 59269076) has the molecular formula C10H18O2 and a molecular weight of 170.25 g/mol.

Molecular Properties

Compound NameCID 59269076
PubChem CID59269076
Molecular FormulaC10H18O2
Molecular Weight170.25 g/mol
Exact Mass170.13
IUPAC Name—
SMILES[CH]CCC1COC(CCC)OC1
InChIInChI=1S/C10H18O2/c1-3-5-9-7-11-10(6-4-2)12-8-9/h1,9-10H,3-8H2,2H3
InChIKeyFQXGTSZHZIVCOQ-UHFFFAOYSA-N
XLogP2.27
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.25
LogP ≤ 52.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of CID 59269076?
The IUPAC name of CID 59269076 (CID 59269076) is not available.
What is the SMILES notation for CID 59269076?
The canonical SMILES for CID 59269076 is [CH]CCC1COC(CCC)OC1.
What is the InChIKey of CID 59269076?
The InChIKey is FQXGTSZHZIVCOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18O2/c1-3-5-9-7-11-10(6-4-2)12-8-9/h1,9-10H,3-8H2,2H3.
What are the key properties of CID 59269076?
CID 59269076 has a molecular weight of 170.25 g/mol, XLogP of 2.27, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 59269076 is sourced from PubChem (CID 59269076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).