(2R)-2-amino-1-(3-hydroxy-8-azabicyclo[3.2.1]octan-8-yl)-2-phenylethanone

C15H20N2O2 — CID 55237223

IUPAC(2R)-2-amino-1-(3-hydroxy-8-azabicyclo[3.2.1]octan-8-yl)-2-phenylethanone
SMILESN[C@@H](C(=O)N1C2CCC1CC(O)C2)c1ccccc1
InChIInChI=1S/C15H20N2O2/c16-14(10-4-2-1-3-5-10)15(19)17-11-6-7-12(17)9-13(18)8-11/h1-5,11-14,18H,6-9,16H2/t11?,12?,13?,14-/m1/s1
InChIKeyFHLGUVDCPDOWAM-SLDMJWGPSA-N
MW260.34 g/mol
LogP1.20
Rot. Bonds2

About (2R)-2-amino-1-(3-hydroxy-8-azabicyclo[3.2.1]octan-8-yl)-2-phenylethanone

(2R)-2-amino-1-(3-hydroxy-8-azabicyclo[3.2.1]octan-8-yl)-2-phenylethanone (PubChem CID 55237223) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is (2R)-2-amino-1-(3-hydroxy-8-azabicyclo[3.2.1]octan-8-yl)-2-phenylethanone.

Molecular Properties

Compound Name(2R)-2-amino-1-(3-hydroxy-8-azabicyclo[3.2.1]octan-8-yl)-2-phenylethanone
PubChem CID55237223
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC Name(2R)-2-amino-1-(3-hydroxy-8-azabicyclo[3.2.1]octan-8-yl)-2-phenylethanone
SMILESN[C@@H](C(=O)N1C2CCC1CC(O)C2)c1ccccc1
InChIInChI=1S/C15H20N2O2/c16-14(10-4-2-1-3-5-10)15(19)17-11-6-7-12(17)9-13(18)8-11/h1-5,11-14,18H,6-9,16H2/t11?,12?,13?,14-/m1/s1
InChIKeyFHLGUVDCPDOWAM-SLDMJWGPSA-N
XLogP1.20
TPSA66.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 51.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze (2R)-2-amino-1-(3-hydroxy-8-azabicyclo[3.2.1]octan-8-yl)-2-phenylethanone with MolForge

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Related Compounds

1-[(1S,5S)-3-hydroxy-8-azabicyclo[3.2.1]octan-8-yl]-2,2-diphenylethanone
CID 98176888
2-amino-1-(3-hydroxy-8-azabicyclo[3.2.1]octan-8-yl)-2-(4-methylphenyl)ethanone;hydrochloride
CID 120667028
2-amino-1-(2-azabicyclo[2.2.1]heptan-2-yl)-2-phenylethanone
CID 54980977
1-(3-amino-8-azabicyclo[3.2.1]octan-8-yl)-2-hydroxy-2-phenylethanone
CID 61234954
2-(3-aminophenyl)-1-(3-hydroxy-8-azabicyclo[3.2.1]octan-8-yl)propan-1-one
CID 106591460
2-amino-2-phenylacetic acid;benzene
CID 18446848
(2R)-2-amino-2-((1,2,3,4,5,6-13C6)cyclohexatrienyl)acetic acid
CID 71309299
2-amino-1-[4-(4-methylcyclohexyl)piperazin-1-yl]-2-phenylethanone
CID 119887445
2-amino-1-(3,4-dimethylpiperidin-1-yl)-2-phenylethanone
CID 86784489
2-amino-2-phenyl-1-pyrrolidin-1-ylethanone
CID 24693981
3-(3-hydroxy-8-azabicyclo[3.2.1]octan-8-yl)-2-methyl-3-oxopropanoic acid
CID 114898469
2-amino-2-phenyl-1-(4-pyrrolidin-1-ylpiperidin-1-yl)ethanone;dihydrochloride
CID 119843387

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-1-(3-hydroxy-8-azabicyclo[3.2.1]octan-8-yl)-2-phenylethanone?
The IUPAC name of (2R)-2-amino-1-(3-hydroxy-8-azabicyclo[3.2.1]octan-8-yl)-2-phenylethanone (CID 55237223) is (2R)-2-amino-1-(3-hydroxy-8-azabicyclo[3.2.1]octan-8-yl)-2-phenylethanone.
What is the SMILES notation for (2R)-2-amino-1-(3-hydroxy-8-azabicyclo[3.2.1]octan-8-yl)-2-phenylethanone?
The canonical SMILES for (2R)-2-amino-1-(3-hydroxy-8-azabicyclo[3.2.1]octan-8-yl)-2-phenylethanone is N[C@@H](C(=O)N1C2CCC1CC(O)C2)c1ccccc1.
What is the InChIKey of (2R)-2-amino-1-(3-hydroxy-8-azabicyclo[3.2.1]octan-8-yl)-2-phenylethanone?
The InChIKey is FHLGUVDCPDOWAM-SLDMJWGPSA-N. The full InChI is InChI=1S/C15H20N2O2/c16-14(10-4-2-1-3-5-10)15(19)17-11-6-7-12(17)9-13(18)8-11/h1-5,11-14,18H,6-9,16H2/t11?,12?,13?,14-/m1/s1.
What are the key properties of (2R)-2-amino-1-(3-hydroxy-8-azabicyclo[3.2.1]octan-8-yl)-2-phenylethanone?
(2R)-2-amino-1-(3-hydroxy-8-azabicyclo[3.2.1]octan-8-yl)-2-phenylethanone has a molecular weight of 260.34 g/mol, XLogP of 1.20, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-1-(3-hydroxy-8-azabicyclo[3.2.1]octan-8-yl)-2-phenylethanone is sourced from PubChem (CID 55237223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).