(5S)-8-methyl-2,3,5,6,7,8-hexahydro-1H-cyclopenta[g]naphthalen-5-ol

C14H18O — CID 115483234

IUPAC(5S)-8-methyl-2,3,5,6,7,8-hexahydro-1H-cyclopenta[g]naphthalen-5-ol
SMILESCC1CC[C@H](O)c2cc3c(cc21)CCC3
InChIInChI=1S/C14H18O/c1-9-5-6-14(15)13-8-11-4-2-3-10(11)7-12(9)13/h7-9,14-15H,2-6H2,1H3/t9?,14-/m0/s1
InChIKeyDSOLUMGDCORFFQ-RJSPSEDBSA-N
MW202.30 g/mol
LogP3.11
Rot. Bonds

About (5S)-8-methyl-2,3,5,6,7,8-hexahydro-1H-cyclopenta[g]naphthalen-5-ol

(5S)-8-methyl-2,3,5,6,7,8-hexahydro-1H-cyclopenta[g]naphthalen-5-ol (PubChem CID 115483234) has the molecular formula C14H18O and a molecular weight of 202.30 g/mol. Its IUPAC name is (5S)-8-methyl-2,3,5,6,7,8-hexahydro-1H-cyclopenta[g]naphthalen-5-ol.

Molecular Properties

Compound Name(5S)-8-methyl-2,3,5,6,7,8-hexahydro-1H-cyclopenta[g]naphthalen-5-ol
PubChem CID115483234
Molecular FormulaC14H18O
Molecular Weight202.30 g/mol
Exact Mass202.14
IUPAC Name(5S)-8-methyl-2,3,5,6,7,8-hexahydro-1H-cyclopenta[g]naphthalen-5-ol
SMILESCC1CC[C@H](O)c2cc3c(cc21)CCC3
InChIInChI=1S/C14H18O/c1-9-5-6-14(15)13-8-11-4-2-3-10(11)7-12(9)13/h7-9,14-15H,2-6H2,1H3/t9?,14-/m0/s1
InChIKeyDSOLUMGDCORFFQ-RJSPSEDBSA-N
XLogP3.11
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.30
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

8-methyl-2,3,5,6,7,8-hexahydro-1H-cyclopenta[g]naphthalen-5-ol
CID 115483235
(1R)-4-methyl-1,2,3,4,5,6,7,8-octahydroanthracen-1-ol
CID 115483213
(1S)-6,7-diethyl-4-methyl-1,2,3,4-tetrahydronaphthalen-1-ol
CID 115483246
N-ethyl-8-methyl-2,3,5,6,7,8-hexahydro-1H-cyclopenta[g]naphthalen-5-amine
CID 113319273
(6S)-2,3,4,6,7,8,9,10-octahydro-1H-cyclohepta[b]naphthalen-6-ol
CID 115483216
(1S)-7-chloro-4-methyl-1,2,3,4-tetrahydronaphthalen-1-ol
CID 115417859
(1R)-7-tert-butyl-4-methyl-1,2,3,4-tetrahydronaphthalen-1-ol
CID 115417895
4-propan-2-yl-1,2,3,5,6,7-hexahydro-s-indacen-1-ol
CID 134258266
(1S)-4-methyl-7-(2-methylbutan-2-yl)-1,2,3,4-tetrahydronaphthalen-1-ol
CID 113305867
7,7-dimethyl-2,3,5,6,8,9-hexahydro-1H-cyclohepta[f]inden-5-ol
CID 113319284
(1R)-5,7-dichloro-4-methyl-1,2,3,4-tetrahydronaphthalen-1-ol
CID 115417892
(1S)-3,3-dimethyl-1,2,5,6,7,8-hexahydrocyclopenta[b]naphthalen-1-ol
CID 115483220

Frequently Asked Questions

What is the IUPAC name of (5S)-8-methyl-2,3,5,6,7,8-hexahydro-1H-cyclopenta[g]naphthalen-5-ol?
The IUPAC name of (5S)-8-methyl-2,3,5,6,7,8-hexahydro-1H-cyclopenta[g]naphthalen-5-ol (CID 115483234) is (5S)-8-methyl-2,3,5,6,7,8-hexahydro-1H-cyclopenta[g]naphthalen-5-ol.
What is the SMILES notation for (5S)-8-methyl-2,3,5,6,7,8-hexahydro-1H-cyclopenta[g]naphthalen-5-ol?
The canonical SMILES for (5S)-8-methyl-2,3,5,6,7,8-hexahydro-1H-cyclopenta[g]naphthalen-5-ol is CC1CC[C@H](O)c2cc3c(cc21)CCC3.
What is the InChIKey of (5S)-8-methyl-2,3,5,6,7,8-hexahydro-1H-cyclopenta[g]naphthalen-5-ol?
The InChIKey is DSOLUMGDCORFFQ-RJSPSEDBSA-N. The full InChI is InChI=1S/C14H18O/c1-9-5-6-14(15)13-8-11-4-2-3-10(11)7-12(9)13/h7-9,14-15H,2-6H2,1H3/t9?,14-/m0/s1.
What are the key properties of (5S)-8-methyl-2,3,5,6,7,8-hexahydro-1H-cyclopenta[g]naphthalen-5-ol?
(5S)-8-methyl-2,3,5,6,7,8-hexahydro-1H-cyclopenta[g]naphthalen-5-ol has a molecular weight of 202.30 g/mol, XLogP of 3.11, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (5S)-8-methyl-2,3,5,6,7,8-hexahydro-1H-cyclopenta[g]naphthalen-5-ol is sourced from PubChem (CID 115483234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).