CID 134859791

C14H20O5 — CID 134859791

IUPAC—
SMILESOC1C2CC3CC(CC1C31OCCO1)C21OCCO1
InChIInChI=1S/C14H20O5/c15-12-10-7-9-5-8(13(10)16-1-2-17-13)6-11(12)14(9)18-3-4-19-14/h8-12,15H,1-7H2
InChIKeyDRMGJFUHYAPLNX-UHFFFAOYSA-N
MW268.31 g/mol
LogP0.51
Rot. Bonds

About CID 134859791

CID 134859791 (PubChem CID 134859791) has the molecular formula C14H20O5 and a molecular weight of 268.31 g/mol.

Molecular Properties

Compound NameCID 134859791
PubChem CID134859791
Molecular FormulaC14H20O5
Molecular Weight268.31 g/mol
Exact Mass268.13
IUPAC Name—
SMILESOC1C2CC3CC(CC1C31OCCO1)C21OCCO1
InChIInChI=1S/C14H20O5/c15-12-10-7-9-5-8(13(10)16-1-2-17-13)6-11(12)14(9)18-3-4-19-14/h8-12,15H,1-7H2
InChIKeyDRMGJFUHYAPLNX-UHFFFAOYSA-N
XLogP0.51
TPSA57.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.31
LogP ≤ 50.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of CID 134859791?
The IUPAC name of CID 134859791 (CID 134859791) is not available.
What is the SMILES notation for CID 134859791?
The canonical SMILES for CID 134859791 is OC1C2CC3CC(CC1C31OCCO1)C21OCCO1.
What is the InChIKey of CID 134859791?
The InChIKey is DRMGJFUHYAPLNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20O5/c15-12-10-7-9-5-8(13(10)16-1-2-17-13)6-11(12)14(9)18-3-4-19-14/h8-12,15H,1-7H2.
What are the key properties of CID 134859791?
CID 134859791 has a molecular weight of 268.31 g/mol, XLogP of 0.51, 0 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for CID 134859791 is sourced from PubChem (CID 134859791), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).