[(1R,5R)-8-benzyl-8-azabicyclo[3.2.1]octan-3-yl]methanol

C15H21NO — CID 98113722

IUPAC[(1R,5R)-8-benzyl-8-azabicyclo[3.2.1]octan-3-yl]methanol
SMILESOCC1C[C@H]2CC[C@H](C1)N2Cc1ccccc1
InChIInChI=1S/C15H21NO/c17-11-13-8-14-6-7-15(9-13)16(14)10-12-4-2-1-3-5-12/h1-5,13-15,17H,6-11H2/t14-,15-/m1/s1
InChIKeyNNUVOEBIDCULPG-HUUCEWRRSA-N
MW231.34 g/mol
LogP2.42
Rot. Bonds3

About [(1R,5R)-8-benzyl-8-azabicyclo[3.2.1]octan-3-yl]methanol

[(1R,5R)-8-benzyl-8-azabicyclo[3.2.1]octan-3-yl]methanol (PubChem CID 98113722) has the molecular formula C15H21NO and a molecular weight of 231.34 g/mol. Its IUPAC name is [(1R,5R)-8-benzyl-8-azabicyclo[3.2.1]octan-3-yl]methanol.

Molecular Properties

Compound Name[(1R,5R)-8-benzyl-8-azabicyclo[3.2.1]octan-3-yl]methanol
PubChem CID98113722
Molecular FormulaC15H21NO
Molecular Weight231.34 g/mol
Exact Mass231.16
IUPAC Name[(1R,5R)-8-benzyl-8-azabicyclo[3.2.1]octan-3-yl]methanol
SMILESOCC1C[C@H]2CC[C@H](C1)N2Cc1ccccc1
InChIInChI=1S/C15H21NO/c17-11-13-8-14-6-7-15(9-13)16(14)10-12-4-2-1-3-5-12/h1-5,13-15,17H,6-11H2/t14-,15-/m1/s1
InChIKeyNNUVOEBIDCULPG-HUUCEWRRSA-N
XLogP2.42
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.34
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze [(1R,5R)-8-benzyl-8-azabicyclo[3.2.1]octan-3-yl]methanol with MolForge

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Related Compounds

8-benzyl-3-ethyl-8-azabicyclo[3.2.1]octane
CID 123647586
(1R,5R)-8-benzyl-8-azabicyclo[3.2.1]octan-3-amine
CID 12832104
2-(8-benzyl-8-azabicyclo[3.2.1]octan-3-yl)acetic acid;hydrochloride
CID 70510965
(1R,5S)-8-benzyl-3-chloro-8-azabicyclo[3.2.1]octane
CID 13382844
[(1S,3S,4R)-2-benzyl-2-azabicyclo[2.2.1]heptan-3-yl]methanol
CID 164554356
8-benzyl-3-phenyl-8-azabicyclo[3.2.1]octane
CID 154275315
N-(8-benzyl-8-azabicyclo[3.2.1]octan-3-yl)-N-methylhydroxylamine
CID 143720504
3-(8-benzyl-8-azabicyclo[3.2.1]octan-3-yl)propanal
CID 83913183
(1R,5R)-9-benzyl-9-azabicyclo[3.3.1]nonan-3-amine
CID 98110557
(1R,5S)-8-benzyl-8-azabicyclo[3.2.1]octane
CID 67134573
(1R,5S)-9-benzyl-9-azabicyclo[3.3.1]nonan-3-amine;dihydrochloride
CID 138376241
9-benzyl-9-azabicyclo[3.3.1]nonan-3-amine;dihydrochloride
CID 53408523

Frequently Asked Questions

What is the IUPAC name of [(1R,5R)-8-benzyl-8-azabicyclo[3.2.1]octan-3-yl]methanol?
The IUPAC name of [(1R,5R)-8-benzyl-8-azabicyclo[3.2.1]octan-3-yl]methanol (CID 98113722) is [(1R,5R)-8-benzyl-8-azabicyclo[3.2.1]octan-3-yl]methanol.
What is the SMILES notation for [(1R,5R)-8-benzyl-8-azabicyclo[3.2.1]octan-3-yl]methanol?
The canonical SMILES for [(1R,5R)-8-benzyl-8-azabicyclo[3.2.1]octan-3-yl]methanol is OCC1C[C@H]2CC[C@H](C1)N2Cc1ccccc1.
What is the InChIKey of [(1R,5R)-8-benzyl-8-azabicyclo[3.2.1]octan-3-yl]methanol?
The InChIKey is NNUVOEBIDCULPG-HUUCEWRRSA-N. The full InChI is InChI=1S/C15H21NO/c17-11-13-8-14-6-7-15(9-13)16(14)10-12-4-2-1-3-5-12/h1-5,13-15,17H,6-11H2/t14-,15-/m1/s1.
What are the key properties of [(1R,5R)-8-benzyl-8-azabicyclo[3.2.1]octan-3-yl]methanol?
[(1R,5R)-8-benzyl-8-azabicyclo[3.2.1]octan-3-yl]methanol has a molecular weight of 231.34 g/mol, XLogP of 2.42, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(1R,5R)-8-benzyl-8-azabicyclo[3.2.1]octan-3-yl]methanol is sourced from PubChem (CID 98113722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).