8-methoxy-15,17-dioxatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8-pentaene

C16H16O3 — CID 101169330

IUPAC8-methoxy-15,17-dioxatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8-pentaene
SMILESCOc1cc2c(c3ccccc13)OC1OCCCC21
InChIInChI=1S/C16H16O3/c1-17-14-9-13-12-7-4-8-18-16(12)19-15(13)11-6-3-2-5-10(11)14/h2-3,5-6,9,12,16H,4,7-8H2,1H3
InChIKeyFOQXFRUBVYEPGA-UHFFFAOYSA-N
MW256.30 g/mol
LogP3.46
Rot. Bonds1

About 8-methoxy-15,17-dioxatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8-pentaene

8-methoxy-15,17-dioxatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8-pentaene (PubChem CID 101169330) has the molecular formula C16H16O3 and a molecular weight of 256.30 g/mol. Its IUPAC name is 8-methoxy-15,17-dioxatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8-pentaene.

Molecular Properties

Compound Name8-methoxy-15,17-dioxatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8-pentaene
PubChem CID101169330
Molecular FormulaC16H16O3
Molecular Weight256.30 g/mol
Exact Mass256.11
IUPAC Name8-methoxy-15,17-dioxatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8-pentaene
SMILESCOc1cc2c(c3ccccc13)OC1OCCCC21
InChIInChI=1S/C16H16O3/c1-17-14-9-13-12-7-4-8-18-16(12)19-15(13)11-6-3-2-5-10(11)14/h2-3,5-6,9,12,16H,4,7-8H2,1H3
InChIKeyFOQXFRUBVYEPGA-UHFFFAOYSA-N
XLogP3.46
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.30
LogP ≤ 53.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 8-methoxy-15,17-dioxatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8-pentaene with MolForge

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Related Compounds

(1R,13R)-4,16-dimethoxy-12,24-dioxahexacyclo[11.11.0.02,11.05,10.014,23.017,22]tetracosa-2(11),3,5,7,9,14(23),15,17,19,21-decaene
CID 15568466
14,16-dioxatetracyclo[8.6.0.03,8.011,15]hexadeca-1,3,5,7,9-pentaen-2-ol
CID 14289254
5-methoxy-2,3-dihydrobenzo[g][1]benzofuran
CID 102108713
(4-methoxynaphthalen-1-yl)-(oxolan-2-yl)methanamine
CID 43150779
methyl (11S,15R)-8-hydroxy-14,16-dioxatetracyclo[8.6.0.02,7.011,15]hexadeca-1(10),2,4,6,8-pentaene-9-carboxylate
CID 71812452
2-(2-bromo-4,5-dimethoxyphenyl)oxan-3-amine
CID 79365326
2-(2,5-dimethoxyphenyl)oxan-3-amine
CID 79364595
(1S)-9-methoxy-4-methyl-1,2,3,4-tetrahydrophenanthren-1-ol
CID 113305846
9-(4-methoxynaphthalen-1-yl)-9-thioniabicyclo[3.3.1]nonane
CID 153168644
6-dibenzofuran-2-yl-8,9-dimethoxy-2,3,4,4a,6,10b-hexahydro-1H-benzo[c]chromene
CID 5305593
(4aS,10bS)-7-methoxy-5,5-dimethyl-3,4,4a,10b-tetrahydro-2H-pyrano[3,2-c]chromene
CID 101012026
5-(4-methoxynaphthalen-1-yl)oxolan-2-one
CID 103439901

Frequently Asked Questions

What is the IUPAC name of 8-methoxy-15,17-dioxatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8-pentaene?
The IUPAC name of 8-methoxy-15,17-dioxatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8-pentaene (CID 101169330) is 8-methoxy-15,17-dioxatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8-pentaene.
What is the SMILES notation for 8-methoxy-15,17-dioxatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8-pentaene?
The canonical SMILES for 8-methoxy-15,17-dioxatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8-pentaene is COc1cc2c(c3ccccc13)OC1OCCCC21.
What is the InChIKey of 8-methoxy-15,17-dioxatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8-pentaene?
The InChIKey is FOQXFRUBVYEPGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16O3/c1-17-14-9-13-12-7-4-8-18-16(12)19-15(13)11-6-3-2-5-10(11)14/h2-3,5-6,9,12,16H,4,7-8H2,1H3.
What are the key properties of 8-methoxy-15,17-dioxatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8-pentaene?
8-methoxy-15,17-dioxatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8-pentaene has a molecular weight of 256.30 g/mol, XLogP of 3.46, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methoxy-15,17-dioxatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8-pentaene is sourced from PubChem (CID 101169330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).