CID 59741466

C15H20O3 — CID 59741466

IUPAC—
SMILES[CH]/C(C)=C/Cc1c(C)c(C)c(OC)c(OC)c1O
InChIInChI=1S/C15H20O3/c1-9(2)7-8-12-10(3)11(4)14(17-5)15(18-6)13(12)16/h1,7,16H,8H2,2-6H3/b9-7-
InChIKeyNXAZURYXNVRSFA-CLFYSBASSA-N
MW248.32 g/mol
LogP3.23
Rot. Bonds4

About CID 59741466

CID 59741466 (PubChem CID 59741466) has the molecular formula C15H20O3 and a molecular weight of 248.32 g/mol.

Molecular Properties

Compound NameCID 59741466
PubChem CID59741466
Molecular FormulaC15H20O3
Molecular Weight248.32 g/mol
Exact Mass248.14
IUPAC Name—
SMILES[CH]/C(C)=C/Cc1c(C)c(C)c(OC)c(OC)c1O
InChIInChI=1S/C15H20O3/c1-9(2)7-8-12-10(3)11(4)14(17-5)15(18-6)13(12)16/h1,7,16H,8H2,2-6H3/b9-7-
InChIKeyNXAZURYXNVRSFA-CLFYSBASSA-N
XLogP3.23
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.32
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of CID 59741466?
The IUPAC name of CID 59741466 (CID 59741466) is not available.
What is the SMILES notation for CID 59741466?
The canonical SMILES for CID 59741466 is [CH]/C(C)=C/Cc1c(C)c(C)c(OC)c(OC)c1O.
What is the InChIKey of CID 59741466?
The InChIKey is NXAZURYXNVRSFA-CLFYSBASSA-N. The full InChI is InChI=1S/C15H20O3/c1-9(2)7-8-12-10(3)11(4)14(17-5)15(18-6)13(12)16/h1,7,16H,8H2,2-6H3/b9-7-.
What are the key properties of CID 59741466?
CID 59741466 has a molecular weight of 248.32 g/mol, XLogP of 3.23, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 59741466 is sourced from PubChem (CID 59741466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).