10-methyl-1,2,3,6,7,8-hexahydrocyclohepta[e]inden-6-ol

C15H18O — CID 129225186

IUPAC10-methyl-1,2,3,6,7,8-hexahydrocyclohepta[e]inden-6-ol
SMILESCC1=CCCC(O)c2ccc3c(c21)CCC3
InChIInChI=1S/C15H18O/c1-10-4-2-7-14(16)13-9-8-11-5-3-6-12(11)15(10)13/h4,8-9,14,16H,2-3,5-7H2,1H3
InChIKeyORSPJKNODIXIII-UHFFFAOYSA-N
MW214.31 g/mol
LogP3.41
Rot. Bonds

About 10-methyl-1,2,3,6,7,8-hexahydrocyclohepta[e]inden-6-ol

10-methyl-1,2,3,6,7,8-hexahydrocyclohepta[e]inden-6-ol (PubChem CID 129225186) has the molecular formula C15H18O and a molecular weight of 214.31 g/mol. Its IUPAC name is 10-methyl-1,2,3,6,7,8-hexahydrocyclohepta[e]inden-6-ol.

Molecular Properties

Compound Name10-methyl-1,2,3,6,7,8-hexahydrocyclohepta[e]inden-6-ol
PubChem CID129225186
Molecular FormulaC15H18O
Molecular Weight214.31 g/mol
Exact Mass214.14
IUPAC Name10-methyl-1,2,3,6,7,8-hexahydrocyclohepta[e]inden-6-ol
SMILESCC1=CCCC(O)c2ccc3c(c21)CCC3
InChIInChI=1S/C15H18O/c1-10-4-2-7-14(16)13-9-8-11-5-3-6-12(11)15(10)13/h4,8-9,14,16H,2-3,5-7H2,1H3
InChIKeyORSPJKNODIXIII-UHFFFAOYSA-N
XLogP3.41
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

5-cyclobutyl-4-methyl-2,3-dihydro-1H-indene
CID 156857499
4-(4-methyl-2,3-dihydro-1H-inden-5-yl)oxane
CID 156857522
5-cyclopropyl-2,3-dihydro-1H-inden-4-amine
CID 162394390
6-(4-methylphenyl)-1,2,3,4-tetrahydronaphthalen-1-ol
CID 169410358
4-(2-hydroxy-5,6,7,8-tetrahydronaphthalen-1-yl)-6,7,8,9-tetrahydro-5H-benzo[7]annulen-3-ol
CID 142874323
1-(2-hydroxy-5,6,7,8-tetrahydronaphthalen-1-yl)-5,6,7,8-tetrahydronaphthalen-2-ol;sulfane
CID 134611635
6-(2-methylphenyl)-1,2,3,4-tetrahydronaphthalen-1-ol
CID 169410347
1-(5-methyl-2,3-dihydro-1H-inden-4-yl)ethanone
CID 13406383
4-propan-2-yl-1,2,3,5,6,7-hexahydro-s-indacen-1-ol
CID 134258266
2,6,7,8-tetrahydro-1H-cyclopenta[e][1]benzofuran;2,6,7,8-tetrahydro-1H-cyclopenta[e][1]benzofuran-8-ol
CID 158381221
12,16-dioxapentacyclo[15.8.0.02,11.03,8.020,25]pentacosa-1(17),2(11),3(8),9,18,20(25)-hexaen-14-ol
CID 118444981
7-(methylamino)-1,2,3,4-tetrahydronaphthalen-1-ol
CID 89110450

Frequently Asked Questions

What is the IUPAC name of 10-methyl-1,2,3,6,7,8-hexahydrocyclohepta[e]inden-6-ol?
The IUPAC name of 10-methyl-1,2,3,6,7,8-hexahydrocyclohepta[e]inden-6-ol (CID 129225186) is 10-methyl-1,2,3,6,7,8-hexahydrocyclohepta[e]inden-6-ol.
What is the SMILES notation for 10-methyl-1,2,3,6,7,8-hexahydrocyclohepta[e]inden-6-ol?
The canonical SMILES for 10-methyl-1,2,3,6,7,8-hexahydrocyclohepta[e]inden-6-ol is CC1=CCCC(O)c2ccc3c(c21)CCC3.
What is the InChIKey of 10-methyl-1,2,3,6,7,8-hexahydrocyclohepta[e]inden-6-ol?
The InChIKey is ORSPJKNODIXIII-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18O/c1-10-4-2-7-14(16)13-9-8-11-5-3-6-12(11)15(10)13/h4,8-9,14,16H,2-3,5-7H2,1H3.
What are the key properties of 10-methyl-1,2,3,6,7,8-hexahydrocyclohepta[e]inden-6-ol?
10-methyl-1,2,3,6,7,8-hexahydrocyclohepta[e]inden-6-ol has a molecular weight of 214.31 g/mol, XLogP of 3.41, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 10-methyl-1,2,3,6,7,8-hexahydrocyclohepta[e]inden-6-ol is sourced from PubChem (CID 129225186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).