6-bicyclo[3.1.0]hexanyl(quinolin-5-yl)methanol

C16H17NO — CID 115826271

IUPAC6-bicyclo[3.1.0]hexanyl(quinolin-5-yl)methanol
SMILESOC(c1cccc2ncccc12)C1C2CCCC21
InChIInChI=1S/C16H17NO/c18-16(15-11-4-1-5-12(11)15)13-6-2-8-14-10(13)7-3-9-17-14/h2-3,6-9,11-12,15-16,18H,1,4-5H2
InChIKeyDMINRCUPRIKGOS-UHFFFAOYSA-N
MW239.32 g/mol
LogP3.31
Rot. Bonds2

About 6-bicyclo[3.1.0]hexanyl(quinolin-5-yl)methanol

6-bicyclo[3.1.0]hexanyl(quinolin-5-yl)methanol (PubChem CID 115826271) has the molecular formula C16H17NO and a molecular weight of 239.32 g/mol. Its IUPAC name is 6-bicyclo[3.1.0]hexanyl(quinolin-5-yl)methanol.

Molecular Properties

Compound Name6-bicyclo[3.1.0]hexanyl(quinolin-5-yl)methanol
PubChem CID115826271
Molecular FormulaC16H17NO
Molecular Weight239.32 g/mol
Exact Mass239.13
IUPAC Name6-bicyclo[3.1.0]hexanyl(quinolin-5-yl)methanol
SMILESOC(c1cccc2ncccc12)C1C2CCCC21
InChIInChI=1S/C16H17NO/c18-16(15-11-4-1-5-12(11)15)13-6-2-8-14-10(13)7-3-9-17-14/h2-3,6-9,11-12,15-16,18H,1,4-5H2
InChIKeyDMINRCUPRIKGOS-UHFFFAOYSA-N
XLogP3.31
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.32
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(7-bicyclo[4.1.0]heptanyl)-N-methyl-1-quinolin-5-ylmethanamine
CID 105020098
2,3-dihydro-1H-inden-2-yl(quinolin-5-yl)methanol
CID 81209914
1-cyclohexyl-2-quinolin-5-ylethane-1,2-diol
CID 103459285
(1R)-1-quinolin-5-ylethanol
CID 86326294
(2S)-2-[(R)-hydroxy(quinolin-5-yl)methyl]-1-azabicyclo[2.2.2]octan-3-ol
CID 101498170
2-cyclopropyl-1-quinolin-5-ylethanamine
CID 79015948
3-cyclopentyl-1-quinolin-5-ylpropan-1-amine
CID 105020216
6-bicyclo[3.1.0]hexanyl-(2,3-dimethylphenyl)methanol
CID 115791560
3-(oxan-2-yl)-1-quinolin-5-ylpropan-1-ol
CID 115826333
(1-methylsulfanylcyclopropyl)-quinolin-5-ylmethanol
CID 114269925
quinolin-5-yl(thiolan-2-yl)methanamine
CID 81224263
(1R)-1-quinolin-5-ylethanamine
CID 55277010

Frequently Asked Questions

What is the IUPAC name of 6-bicyclo[3.1.0]hexanyl(quinolin-5-yl)methanol?
The IUPAC name of 6-bicyclo[3.1.0]hexanyl(quinolin-5-yl)methanol (CID 115826271) is 6-bicyclo[3.1.0]hexanyl(quinolin-5-yl)methanol.
What is the SMILES notation for 6-bicyclo[3.1.0]hexanyl(quinolin-5-yl)methanol?
The canonical SMILES for 6-bicyclo[3.1.0]hexanyl(quinolin-5-yl)methanol is OC(c1cccc2ncccc12)C1C2CCCC21.
What is the InChIKey of 6-bicyclo[3.1.0]hexanyl(quinolin-5-yl)methanol?
The InChIKey is DMINRCUPRIKGOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17NO/c18-16(15-11-4-1-5-12(11)15)13-6-2-8-14-10(13)7-3-9-17-14/h2-3,6-9,11-12,15-16,18H,1,4-5H2.
What are the key properties of 6-bicyclo[3.1.0]hexanyl(quinolin-5-yl)methanol?
6-bicyclo[3.1.0]hexanyl(quinolin-5-yl)methanol has a molecular weight of 239.32 g/mol, XLogP of 3.31, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bicyclo[3.1.0]hexanyl(quinolin-5-yl)methanol is sourced from PubChem (CID 115826271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).