CID 11406474

C15H19O4 — CID 11406474

IUPAC—
SMILESCC(C)OC1=C(OC(C)C)C(O)([C]2[CH][CH][CH][CH]2)C1=O
InChIInChI=1S/C15H19O4/c1-9(2)18-12-13(16)15(17,11-7-5-6-8-11)14(12)19-10(3)4/h5-10,17H,1-4H3
InChIKeyFOXMAQYXAZWPED-UHFFFAOYSA-N
MW263.31 g/mol
LogP1.77
Rot. Bonds5

About CID 11406474

CID 11406474 (PubChem CID 11406474) has the molecular formula C15H19O4 and a molecular weight of 263.31 g/mol.

Molecular Properties

Compound NameCID 11406474
PubChem CID11406474
Molecular FormulaC15H19O4
Molecular Weight263.31 g/mol
Exact Mass263.13
IUPAC Name—
SMILESCC(C)OC1=C(OC(C)C)C(O)([C]2[CH][CH][CH][CH]2)C1=O
InChIInChI=1S/C15H19O4/c1-9(2)18-12-13(16)15(17,11-7-5-6-8-11)14(12)19-10(3)4/h5-10,17H,1-4H3
InChIKeyFOXMAQYXAZWPED-UHFFFAOYSA-N
XLogP1.77
TPSA55.76 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.31
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of CID 11406474?
The IUPAC name of CID 11406474 (CID 11406474) is not available.
What is the SMILES notation for CID 11406474?
The canonical SMILES for CID 11406474 is CC(C)OC1=C(OC(C)C)C(O)([C]2[CH][CH][CH][CH]2)C1=O.
What is the InChIKey of CID 11406474?
The InChIKey is FOXMAQYXAZWPED-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19O4/c1-9(2)18-12-13(16)15(17,11-7-5-6-8-11)14(12)19-10(3)4/h5-10,17H,1-4H3.
What are the key properties of CID 11406474?
CID 11406474 has a molecular weight of 263.31 g/mol, XLogP of 1.77, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for CID 11406474 is sourced from PubChem (CID 11406474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).