spiro[7,8-dihydro-6H-naphthalene-5,3'-pyrrolidine]-2-ol;hydrobromide

C13H18BrNO — CID 12630010

IUPACspiro[7,8-dihydro-6H-naphthalene-5,3'-pyrrolidine]-2-ol;hydrobromide
SMILESBr.Oc1ccc2c(c1)CCCC21CCNC1
InChIInChI=1S/C13H17NO.BrH/c15-11-3-4-12-10(8-11)2-1-5-13(12)6-7-14-9-13;/h3-4,8,14-15H,1-2,5-7,9H2;1H
InChIKeyFEEOIRLWTXLHSQ-UHFFFAOYSA-N
MW284.20 g/mol
LogP2.54
Rot. Bonds

About spiro[7,8-dihydro-6H-naphthalene-5,3'-pyrrolidine]-2-ol;hydrobromide

spiro[7,8-dihydro-6H-naphthalene-5,3'-pyrrolidine]-2-ol;hydrobromide (PubChem CID 12630010) has the molecular formula C13H18BrNO and a molecular weight of 284.20 g/mol. Its IUPAC name is spiro[7,8-dihydro-6H-naphthalene-5,3'-pyrrolidine]-2-ol;hydrobromide.

Molecular Properties

Compound Namespiro[7,8-dihydro-6H-naphthalene-5,3'-pyrrolidine]-2-ol;hydrobromide
PubChem CID12630010
Molecular FormulaC13H18BrNO
Molecular Weight284.20 g/mol
Exact Mass283.06
IUPAC Namespiro[7,8-dihydro-6H-naphthalene-5,3'-pyrrolidine]-2-ol;hydrobromide
SMILESBr.Oc1ccc2c(c1)CCCC21CCNC1
InChIInChI=1S/C13H17NO.BrH/c15-11-3-4-12-10(8-11)2-1-5-13(12)6-7-14-9-13;/h3-4,8,14-15H,1-2,5-7,9H2;1H
InChIKeyFEEOIRLWTXLHSQ-UHFFFAOYSA-N
XLogP2.54
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.20
LogP ≤ 52.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

CID 1208
CID 1208
CID 12371110
CID 12371110
CID 12371111
CID 12371111
CID 10058787
CID 10058787
CID 10466960
CID 10466960
CID 11775984
CID 11775984
CID 10332122
CID 10332122
CID 194526
CID 194526
CID 9836984
CID 9836984
CID 10219748
CID 10219748
CID 10422091
CID 10422091
CID 15922674
CID 15922674

Frequently Asked Questions

What is the IUPAC name of spiro[7,8-dihydro-6H-naphthalene-5,3'-pyrrolidine]-2-ol;hydrobromide?
The IUPAC name of spiro[7,8-dihydro-6H-naphthalene-5,3'-pyrrolidine]-2-ol;hydrobromide (CID 12630010) is spiro[7,8-dihydro-6H-naphthalene-5,3'-pyrrolidine]-2-ol;hydrobromide.
What is the SMILES notation for spiro[7,8-dihydro-6H-naphthalene-5,3'-pyrrolidine]-2-ol;hydrobromide?
The canonical SMILES for spiro[7,8-dihydro-6H-naphthalene-5,3'-pyrrolidine]-2-ol;hydrobromide is Br.Oc1ccc2c(c1)CCCC21CCNC1.
What is the InChIKey of spiro[7,8-dihydro-6H-naphthalene-5,3'-pyrrolidine]-2-ol;hydrobromide?
The InChIKey is FEEOIRLWTXLHSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17NO.BrH/c15-11-3-4-12-10(8-11)2-1-5-13(12)6-7-14-9-13;/h3-4,8,14-15H,1-2,5-7,9H2;1H.
What are the key properties of spiro[7,8-dihydro-6H-naphthalene-5,3'-pyrrolidine]-2-ol;hydrobromide?
spiro[7,8-dihydro-6H-naphthalene-5,3'-pyrrolidine]-2-ol;hydrobromide has a molecular weight of 284.20 g/mol, XLogP of 2.54, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for spiro[7,8-dihydro-6H-naphthalene-5,3'-pyrrolidine]-2-ol;hydrobromide is sourced from PubChem (CID 12630010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).