CID 59269217

C10H16O2 — CID 59269217

IUPAC—
SMILES[CH]CC1COC2(CCCCC2)O1
InChIInChI=1S/C10H16O2/c1-2-9-8-11-10(12-9)6-4-3-5-7-10/h1,9H,2-8H2
InChIKeyKBFYXRTUEKXMAT-UHFFFAOYSA-N
MW168.24 g/mol
LogP2.16
Rot. Bonds1

About CID 59269217

CID 59269217 (PubChem CID 59269217) has the molecular formula C10H16O2 and a molecular weight of 168.24 g/mol.

Molecular Properties

Compound NameCID 59269217
PubChem CID59269217
Molecular FormulaC10H16O2
Molecular Weight168.24 g/mol
Exact Mass168.12
IUPAC Name—
SMILES[CH]CC1COC2(CCCCC2)O1
InChIInChI=1S/C10H16O2/c1-2-9-8-11-10(12-9)6-4-3-5-7-10/h1,9H,2-8H2
InChIKeyKBFYXRTUEKXMAT-UHFFFAOYSA-N
XLogP2.16
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.24
LogP ≤ 52.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of CID 59269217?
The IUPAC name of CID 59269217 (CID 59269217) is not available.
What is the SMILES notation for CID 59269217?
The canonical SMILES for CID 59269217 is [CH]CC1COC2(CCCCC2)O1.
What is the InChIKey of CID 59269217?
The InChIKey is KBFYXRTUEKXMAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16O2/c1-2-9-8-11-10(12-9)6-4-3-5-7-10/h1,9H,2-8H2.
What are the key properties of CID 59269217?
CID 59269217 has a molecular weight of 168.24 g/mol, XLogP of 2.16, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 59269217 is sourced from PubChem (CID 59269217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).