(2R)-2-amino-2-(2,6-dimethyl-3-pyridinyl)ethanol

C9H14N2O — CID 96740448

IUPAC(2R)-2-amino-2-(2,6-dimethyl-3-pyridinyl)ethanol
SMILESCc1ccc([C@@H](N)CO)c(C)n1
InChIInChI=1S/C9H14N2O/c1-6-3-4-8(7(2)11-6)9(10)5-12/h3-4,9,12H,5,10H2,1-2H3/t9-/m0/s1
InChIKeyXVBDZLONJXRWQQ-VIFPVBQESA-N
MW166.22 g/mol
LogP0.69
Rot. Bonds2

About (2R)-2-amino-2-(2,6-dimethyl-3-pyridinyl)ethanol

(2R)-2-amino-2-(2,6-dimethyl-3-pyridinyl)ethanol (PubChem CID 96740448) has the molecular formula C9H14N2O and a molecular weight of 166.22 g/mol. Its IUPAC name is (2R)-2-amino-2-(2,6-dimethyl-3-pyridinyl)ethanol.

Molecular Properties

Compound Name(2R)-2-amino-2-(2,6-dimethyl-3-pyridinyl)ethanol
PubChem CID96740448
Molecular FormulaC9H14N2O
Molecular Weight166.22 g/mol
Exact Mass166.11
IUPAC Name(2R)-2-amino-2-(2,6-dimethyl-3-pyridinyl)ethanol
SMILESCc1ccc([C@@H](N)CO)c(C)n1
InChIInChI=1S/C9H14N2O/c1-6-3-4-8(7(2)11-6)9(10)5-12/h3-4,9,12H,5,10H2,1-2H3/t9-/m0/s1
InChIKeyXVBDZLONJXRWQQ-VIFPVBQESA-N
XLogP0.69
TPSA59.14 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.22
LogP ≤ 50.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-3-(2,6-dimethyl-3-pyridinyl)propanoic acid
CID 55296014
(1S)-1-(2,6-dimethyl-3-pyridinyl)-2-methoxyethanamine
CID 55294133
1-(2,6-dimethyl-3-pyridinyl)-3-methylidenepentan-1-amine
CID 105163949
(1R,2S)-1-amino-1-(2,6-dimethyl-3-pyridinyl)propan-2-ol
CID 55292437
1-(2,6-dimethyl-3-pyridinyl)pent-3-yn-1-amine
CID 105112231
bis(2,6-dimethyl-3-pyridinyl)methanol
CID 141423650
(2S)-2-amino-2-(2-methyl-3-pyridinyl)ethanol
CID 55263472
(2S)-2-amino-2-(3-fluoro-6-methyl-2-pyridinyl)ethanol;dihydrochloride
CID 67033137
1-(2,6-dimethyl-3-pyridinyl)-2-methylpropan-1-ol
CID 105133610
1-(2,6-dimethyl-3-pyridinyl)-2-ethylbutan-1-ol
CID 105114692
(R)-cyclopropyl-(2,6-dimethyl-3-pyridinyl)methanamine
CID 55262974
(2S)-2-amino-2-(6-methyl-3-pyridinyl)ethanol;dihydrochloride
CID 67034159

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-2-(2,6-dimethyl-3-pyridinyl)ethanol?
The IUPAC name of (2R)-2-amino-2-(2,6-dimethyl-3-pyridinyl)ethanol (CID 96740448) is (2R)-2-amino-2-(2,6-dimethyl-3-pyridinyl)ethanol.
What is the SMILES notation for (2R)-2-amino-2-(2,6-dimethyl-3-pyridinyl)ethanol?
The canonical SMILES for (2R)-2-amino-2-(2,6-dimethyl-3-pyridinyl)ethanol is Cc1ccc([C@@H](N)CO)c(C)n1.
What is the InChIKey of (2R)-2-amino-2-(2,6-dimethyl-3-pyridinyl)ethanol?
The InChIKey is XVBDZLONJXRWQQ-VIFPVBQESA-N. The full InChI is InChI=1S/C9H14N2O/c1-6-3-4-8(7(2)11-6)9(10)5-12/h3-4,9,12H,5,10H2,1-2H3/t9-/m0/s1.
What are the key properties of (2R)-2-amino-2-(2,6-dimethyl-3-pyridinyl)ethanol?
(2R)-2-amino-2-(2,6-dimethyl-3-pyridinyl)ethanol has a molecular weight of 166.22 g/mol, XLogP of 0.69, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-2-(2,6-dimethyl-3-pyridinyl)ethanol is sourced from PubChem (CID 96740448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).