9-ethyl-14-methoxytricyclo[9.4.0.03,8]pentadeca-1(11),3,5,7,12,14-hexaen-9-ol

C18H20O2 — CID 59941548

IUPAC9-ethyl-14-methoxytricyclo[9.4.0.03,8]pentadeca-1(11),3,5,7,12,14-hexaen-9-ol
SMILESCCC1(O)Cc2ccc(OC)cc2Cc2ccccc21
InChIInChI=1S/C18H20O2/c1-3-18(19)12-14-8-9-16(20-2)11-15(14)10-13-6-4-5-7-17(13)18/h4-9,11,19H,3,10,12H2,1-2H3
InChIKeyCZAYHSHLPRSIDK-UHFFFAOYSA-N
MW268.36 g/mol
LogP3.44
Rot. Bonds2

About 9-ethyl-14-methoxytricyclo[9.4.0.03,8]pentadeca-1(11),3,5,7,12,14-hexaen-9-ol

9-ethyl-14-methoxytricyclo[9.4.0.03,8]pentadeca-1(11),3,5,7,12,14-hexaen-9-ol (PubChem CID 59941548) has the molecular formula C18H20O2 and a molecular weight of 268.36 g/mol. Its IUPAC name is 9-ethyl-14-methoxytricyclo[9.4.0.03,8]pentadeca-1(11),3,5,7,12,14-hexaen-9-ol.

Molecular Properties

Compound Name9-ethyl-14-methoxytricyclo[9.4.0.03,8]pentadeca-1(11),3,5,7,12,14-hexaen-9-ol
PubChem CID59941548
Molecular FormulaC18H20O2
Molecular Weight268.36 g/mol
Exact Mass268.15
IUPAC Name9-ethyl-14-methoxytricyclo[9.4.0.03,8]pentadeca-1(11),3,5,7,12,14-hexaen-9-ol
SMILESCCC1(O)Cc2ccc(OC)cc2Cc2ccccc21
InChIInChI=1S/C18H20O2/c1-3-18(19)12-14-8-9-16(20-2)11-15(14)10-13-6-4-5-7-17(13)18/h4-9,11,19H,3,10,12H2,1-2H3
InChIKeyCZAYHSHLPRSIDK-UHFFFAOYSA-N
XLogP3.44
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 9-ethyl-14-methoxytricyclo[9.4.0.03,8]pentadeca-1(11),3,5,7,12,14-hexaen-9-ol with MolForge

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Related Compounds

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CID 59613649
ethane;1-ethyl-2,3-dihydroinden-1-ol
CID 90872603
2-methoxy-9H-thioxanthene 10-oxide
CID 640900
2-[(3-methoxyphenyl)methyl]-1,3-dihydroinden-2-ol
CID 65147763
2-(hydroxymethyl)-6-methoxy-3,4-dihydro-1H-naphthalen-2-ol
CID 105461731
2-cyclopropyl-6-methoxytricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,11,13-hexaen-2-ol
CID 19261422
9-methoxy-12,12-dimethyl-5H-tetracene
CID 159569576
5,6,12,13,19-pentamethoxytetracyclo[15.4.0.03,8.010,15]henicosa-1(17),3,5,7,10,12,14,18,20-nonaene
CID 102106088
2-(4-methoxyphenyl)-1,3-dihydroinden-2-ol
CID 15112860
N-[(1-hydroxy-2,3-dihydroinden-1-yl)methyl]-2,5-dimethoxybenzenesulfonamide
CID 71782189
13-methoxyhexacyclo[7.7.7.01,9.02,7.011,16.017,22]tricosa-2,4,6,11(16),12,14,17,19,21-nonaen-8-one
CID 14874013
N-[(1-hydroxy-2,3-dihydroinden-1-yl)methyl]-3-methoxybenzenesulfonamide
CID 90499095

Frequently Asked Questions

What is the IUPAC name of 9-ethyl-14-methoxytricyclo[9.4.0.03,8]pentadeca-1(11),3,5,7,12,14-hexaen-9-ol?
The IUPAC name of 9-ethyl-14-methoxytricyclo[9.4.0.03,8]pentadeca-1(11),3,5,7,12,14-hexaen-9-ol (CID 59941548) is 9-ethyl-14-methoxytricyclo[9.4.0.03,8]pentadeca-1(11),3,5,7,12,14-hexaen-9-ol.
What is the SMILES notation for 9-ethyl-14-methoxytricyclo[9.4.0.03,8]pentadeca-1(11),3,5,7,12,14-hexaen-9-ol?
The canonical SMILES for 9-ethyl-14-methoxytricyclo[9.4.0.03,8]pentadeca-1(11),3,5,7,12,14-hexaen-9-ol is CCC1(O)Cc2ccc(OC)cc2Cc2ccccc21.
What is the InChIKey of 9-ethyl-14-methoxytricyclo[9.4.0.03,8]pentadeca-1(11),3,5,7,12,14-hexaen-9-ol?
The InChIKey is CZAYHSHLPRSIDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20O2/c1-3-18(19)12-14-8-9-16(20-2)11-15(14)10-13-6-4-5-7-17(13)18/h4-9,11,19H,3,10,12H2,1-2H3.
What are the key properties of 9-ethyl-14-methoxytricyclo[9.4.0.03,8]pentadeca-1(11),3,5,7,12,14-hexaen-9-ol?
9-ethyl-14-methoxytricyclo[9.4.0.03,8]pentadeca-1(11),3,5,7,12,14-hexaen-9-ol has a molecular weight of 268.36 g/mol, XLogP of 3.44, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-ethyl-14-methoxytricyclo[9.4.0.03,8]pentadeca-1(11),3,5,7,12,14-hexaen-9-ol is sourced from PubChem (CID 59941548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).