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

Analyze CID 59741466 with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-methoxy-3,5-dimethyl-6-[(E)-3-methylpent-2-enyl]benzene-1,4-diol
CID 58954650
2,3-dimethoxy-5-methyl-6-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienyl]benzene-1,4-diol
CID 10992743
2-[(2Z,6E,10E,14E,18E)-3,7,11,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaenyl]-5,6-dimethoxy-3-methylbenzene-1,4-diol
CID 175646711
2-[(2E,6E)-3,7-dimethylnona-2,6-dienyl]-5,6-dimethoxy-3-methylbenzene-1,4-diol
CID 164890062
2-[(2E,6E,10E,14E,18Z,22Z)-3,7,11,15,19,23,27-heptamethyloctacosa-2,6,10,14,18,22,26-heptaenyl]-5,6-dimethoxy-3-methylbenzene-1,4-diol
CID 66563646
2,3-dimethoxy-5-methyl-6-(3,7,11-trimethyldodeca-2,6,10-trienyl)benzene-1,4-diol
CID 85358878
2,3-dimethoxy-5-methyl-6-[(2E,6Z,10E,14E)-3,7,11,15-tetramethyloctadeca-2,6,10,14-tetraenyl]benzene-1,4-diol
CID 154815659
2-[(2E,6Z,10E,14Z,18E,22E,26E,30E,34Z)-3,7,11,15,19,23,27,31,35,39-decamethyltetraconta-2,6,10,14,18,22,26,30,34,38-decaenyl]-5,6-dimethoxy-3-methylbenzene-1,4-diol
CID 163183422
2,3-dimethoxy-5-methyl-6-[(2E,6Z,10E,14Z)-3,7,11-trimethylhexadeca-2,6,10,14-tetraenyl]benzene-1,4-diol
CID 171662232
2,3-dimethoxy-5-methyl-6-[(2E,6E,10E)-3,7,11-trimethylpentadeca-2,6,10,14-tetraenyl]benzene-1,4-diol
CID 172636036
2-methoxy-6-methyl-5-[(E)-3-methylpent-2-enyl]-3-[(2-methylpropan-2-yl)oxy]benzene-1,4-diol
CID 58954675
5-(3,7,11,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaenyl)-3-methoxy-6-methylbenzene-1,2,4-triol
CID 25203764

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).