7-bromospiro[3,4-dihydro-2H-naphthalene-1,1'-cyclopentane]-2-ol

C14H17BrO — CID 115010781

IUPAC7-bromospiro[3,4-dihydro-2H-naphthalene-1,1'-cyclopentane]-2-ol
SMILESOC1CCc2ccc(Br)cc2C12CCCC2
InChIInChI=1S/C14H17BrO/c15-11-5-3-10-4-6-13(16)14(12(10)9-11)7-1-2-8-14/h3,5,9,13,16H,1-2,4,6-8H2
InChIKeyUQGBJLSBMINWTR-UHFFFAOYSA-N
MW281.19 g/mol
LogP3.57
Rot. Bonds

About 7-bromospiro[3,4-dihydro-2H-naphthalene-1,1'-cyclopentane]-2-ol

7-bromospiro[3,4-dihydro-2H-naphthalene-1,1'-cyclopentane]-2-ol (PubChem CID 115010781) has the molecular formula C14H17BrO and a molecular weight of 281.19 g/mol. Its IUPAC name is 7-bromospiro[3,4-dihydro-2H-naphthalene-1,1'-cyclopentane]-2-ol.

Molecular Properties

Compound Name7-bromospiro[3,4-dihydro-2H-naphthalene-1,1'-cyclopentane]-2-ol
PubChem CID115010781
Molecular FormulaC14H17BrO
Molecular Weight281.19 g/mol
Exact Mass280.05
IUPAC Name7-bromospiro[3,4-dihydro-2H-naphthalene-1,1'-cyclopentane]-2-ol
SMILESOC1CCc2ccc(Br)cc2C12CCCC2
InChIInChI=1S/C14H17BrO/c15-11-5-3-10-4-6-13(16)14(12(10)9-11)7-1-2-8-14/h3,5,9,13,16H,1-2,4,6-8H2
InChIKeyUQGBJLSBMINWTR-UHFFFAOYSA-N
XLogP3.57
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.19
LogP ≤ 53.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 7-bromospiro[3,4-dihydro-2H-naphthalene-1,1'-cyclopentane]-2-ol with MolForge

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Related Compounds

7-methoxyspiro[3,4-dihydro-2H-naphthalene-1,1'-cyclopropane]-2-ol
CID 115010787
6-bromospiro[3,4-dihydro-2H-naphthalene-1,1'-cyclopentane]-2-carboxylic acid
CID 115057075
7-bromo-1,2,3,4-tetrahydronaphthalen-2-ol
CID 105484321
6-bromospiro[3,4-dihydro-2H-naphthalene-1,1'-cyclobutane]-2-amine
CID 115057072
8-methylspiro[3,4-dihydro-2H-naphthalene-1,1'-cyclopentane]-2-ol
CID 115010719
(6-bromospiro[3,4-dihydro-2H-naphthalene-1,1'-cyclobutane]-2-yl)methanamine
CID 115057341
6-bromo-4,4-dimethyl-2,3-dihydro-1H-naphthalene
CID 10537940
5-methoxyspiro[3,4-dihydro-2H-naphthalene-1,1'-cyclohexane]-2-ol
CID 115010876
5-fluorospiro[3,4-dihydro-2H-naphthalene-1,1'-cyclohexane]-2-ol
CID 115010849
(2'R,3S)-5-bromo-2'-isocyanatospiro[1,2-dihydroindene-3,1'-cyclopropane]
CID 129294096
(3R)-5-bromospiro[1,2-dihydroindene-3,5'-imidazolidine]-2',4'-dione
CID 154872521
7-bromospiro[3,4-dihydrochromene-2,1'-cyclohexane]
CID 164899375

Frequently Asked Questions

What is the IUPAC name of 7-bromospiro[3,4-dihydro-2H-naphthalene-1,1'-cyclopentane]-2-ol?
The IUPAC name of 7-bromospiro[3,4-dihydro-2H-naphthalene-1,1'-cyclopentane]-2-ol (CID 115010781) is 7-bromospiro[3,4-dihydro-2H-naphthalene-1,1'-cyclopentane]-2-ol.
What is the SMILES notation for 7-bromospiro[3,4-dihydro-2H-naphthalene-1,1'-cyclopentane]-2-ol?
The canonical SMILES for 7-bromospiro[3,4-dihydro-2H-naphthalene-1,1'-cyclopentane]-2-ol is OC1CCc2ccc(Br)cc2C12CCCC2.
What is the InChIKey of 7-bromospiro[3,4-dihydro-2H-naphthalene-1,1'-cyclopentane]-2-ol?
The InChIKey is UQGBJLSBMINWTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17BrO/c15-11-5-3-10-4-6-13(16)14(12(10)9-11)7-1-2-8-14/h3,5,9,13,16H,1-2,4,6-8H2.
What are the key properties of 7-bromospiro[3,4-dihydro-2H-naphthalene-1,1'-cyclopentane]-2-ol?
7-bromospiro[3,4-dihydro-2H-naphthalene-1,1'-cyclopentane]-2-ol has a molecular weight of 281.19 g/mol, XLogP of 3.57, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7-bromospiro[3,4-dihydro-2H-naphthalene-1,1'-cyclopentane]-2-ol is sourced from PubChem (CID 115010781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).