spiro[7,8-dihydro-6H-naphthalene-5,1'-cyclohexane]-2-ylmethanol

C16H22O — CID 10775833

IUPACspiro[7,8-dihydro-6H-naphthalene-5,1'-cyclohexane]-2-ylmethanol
SMILESOCc1ccc2c(c1)CCCC21CCCCC1
InChIInChI=1S/C16H22O/c17-12-13-6-7-15-14(11-13)5-4-10-16(15)8-2-1-3-9-16/h6-7,11,17H,1-5,8-10,12H2
InChIKeyFKQXVOOAKSPBSB-UHFFFAOYSA-N
MW230.35 g/mol
LogP3.72
Rot. Bonds1

About spiro[7,8-dihydro-6H-naphthalene-5,1'-cyclohexane]-2-ylmethanol

spiro[7,8-dihydro-6H-naphthalene-5,1'-cyclohexane]-2-ylmethanol (PubChem CID 10775833) has the molecular formula C16H22O and a molecular weight of 230.35 g/mol. Its IUPAC name is spiro[7,8-dihydro-6H-naphthalene-5,1'-cyclohexane]-2-ylmethanol.

Molecular Properties

Compound Namespiro[7,8-dihydro-6H-naphthalene-5,1'-cyclohexane]-2-ylmethanol
PubChem CID10775833
Molecular FormulaC16H22O
Molecular Weight230.35 g/mol
Exact Mass230.17
IUPAC Namespiro[7,8-dihydro-6H-naphthalene-5,1'-cyclohexane]-2-ylmethanol
SMILESOCc1ccc2c(c1)CCCC21CCCCC1
InChIInChI=1S/C16H22O/c17-12-13-6-7-15-14(11-13)5-4-10-16(15)8-2-1-3-9-16/h6-7,11,17H,1-5,8-10,12H2
InChIKeyFKQXVOOAKSPBSB-UHFFFAOYSA-N
XLogP3.72
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.35
LogP ≤ 53.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

spiro[7,8-dihydro-6H-naphthalene-5,3'-pyrrolidine]-2-ol;hydrobromide
CID 12630010
(4R)-7-bromospiro[2,3-dihydro-1H-naphthalene-4,3'-pyrrolidine]
CID 129384980
3-iodospiro[6,7,8,9-tetrahydrobenzo[7]annulene-5,1'-cyclopropane];3-nitrospiro[6,7,8,9-tetrahydrobenzo[7]annulene-5,1'-cyclopropane];spiro[6,7,8,9-tetrahydrobenzo[7]annulene-5,1'-cyclopropane]-3-carboxylic acid;spiro[6,7,8,9-tetrahydrobenzo[7]annulene-5,1'-cyclopropane]-3-ylmethanol
CID 161154481
(4S)-7-methoxyspiro[2,3-dihydro-1H-naphthalene-4,3'-pyrrolidine]
CID 92849621
[3-(1-aminocyclopentyl)-4-fluorophenyl]methanol
CID 117298948
(2,2-dimethyl-3,4-dihydro-1H-quinolin-6-yl)methanol
CID 15720423
3,3-dimethyl-6-(2-methylprop-2-enyl)-1,2-dihydroindene
CID 173288330
4-(hydroxymethyl)-2-[(1S)-1,2,2-trimethylcyclopentyl]phenol
CID 15519737
7-(hydroxymethyl)-4,4-dimethyl-2,3-dihydro-1H-naphthalen-2-ol
CID 144629236
(1'-methylspiro[1,3-dihydroindene-2,4'-piperidine]-5-yl)methanol
CID 167048183
(1-amino-6-methyl-3,4-dihydro-2H-naphthalen-1-yl)methanol
CID 83907370
[(1R,9S)-15-amino-1-methyl-4-tricyclo[7.5.1.02,7]pentadeca-2(7),3,5-trienyl]methanol
CID 153437146

Frequently Asked Questions

What is the IUPAC name of spiro[7,8-dihydro-6H-naphthalene-5,1'-cyclohexane]-2-ylmethanol?
The IUPAC name of spiro[7,8-dihydro-6H-naphthalene-5,1'-cyclohexane]-2-ylmethanol (CID 10775833) is spiro[7,8-dihydro-6H-naphthalene-5,1'-cyclohexane]-2-ylmethanol.
What is the SMILES notation for spiro[7,8-dihydro-6H-naphthalene-5,1'-cyclohexane]-2-ylmethanol?
The canonical SMILES for spiro[7,8-dihydro-6H-naphthalene-5,1'-cyclohexane]-2-ylmethanol is OCc1ccc2c(c1)CCCC21CCCCC1.
What is the InChIKey of spiro[7,8-dihydro-6H-naphthalene-5,1'-cyclohexane]-2-ylmethanol?
The InChIKey is FKQXVOOAKSPBSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22O/c17-12-13-6-7-15-14(11-13)5-4-10-16(15)8-2-1-3-9-16/h6-7,11,17H,1-5,8-10,12H2.
What are the key properties of spiro[7,8-dihydro-6H-naphthalene-5,1'-cyclohexane]-2-ylmethanol?
spiro[7,8-dihydro-6H-naphthalene-5,1'-cyclohexane]-2-ylmethanol has a molecular weight of 230.35 g/mol, XLogP of 3.72, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for spiro[7,8-dihydro-6H-naphthalene-5,1'-cyclohexane]-2-ylmethanol is sourced from PubChem (CID 10775833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).