(1R)-2-(tert-butylamino)-1-[6-(2-methylphenyl)-2-pyridinyl]ethanol

C18H24N2O — CID 155154266

IUPAC(1R)-2-(tert-butylamino)-1-[6-(2-methylphenyl)-2-pyridinyl]ethanol
SMILESCc1ccccc1-c1cccc([C@H](O)CNC(C)(C)C)n1
InChIInChI=1S/C18H24N2O/c1-13-8-5-6-9-14(13)15-10-7-11-16(20-15)17(21)12-19-18(2,3)4/h5-11,17,19,21H,12H2,1-4H3/t17-/m1/s1
InChIKeyLYNMYCZREDHVQI-QGZVFWFLSA-N
MW284.40 g/mol
LogP3.48
Rot. Bonds4

About (1R)-2-(tert-butylamino)-1-[6-(2-methylphenyl)-2-pyridinyl]ethanol

(1R)-2-(tert-butylamino)-1-[6-(2-methylphenyl)-2-pyridinyl]ethanol (PubChem CID 155154266) has the molecular formula C18H24N2O and a molecular weight of 284.40 g/mol. Its IUPAC name is (1R)-2-(tert-butylamino)-1-[6-(2-methylphenyl)-2-pyridinyl]ethanol.

Molecular Properties

Compound Name(1R)-2-(tert-butylamino)-1-[6-(2-methylphenyl)-2-pyridinyl]ethanol
PubChem CID155154266
Molecular FormulaC18H24N2O
Molecular Weight284.40 g/mol
Exact Mass284.19
IUPAC Name(1R)-2-(tert-butylamino)-1-[6-(2-methylphenyl)-2-pyridinyl]ethanol
SMILESCc1ccccc1-c1cccc([C@H](O)CNC(C)(C)C)n1
InChIInChI=1S/C18H24N2O/c1-13-8-5-6-9-14(13)15-10-7-11-16(20-15)17(21)12-19-18(2,3)4/h5-11,17,19,21H,12H2,1-4H3/t17-/m1/s1
InChIKeyLYNMYCZREDHVQI-QGZVFWFLSA-N
XLogP3.48
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 53.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(1S)-2-(tert-butylamino)-1-(6-tert-butyl-2-pyridinyl)ethanol
CID 155154303
(1S)-1-(6-amino-2-pyridinyl)-2-(tert-butylamino)ethanol
CID 155162177
(1S)-2-(tert-butylamino)-1-[6-(methylamino)-2-pyridinyl]ethanol
CID 155154418
(1S)-1-(6-anilino-2-pyridinyl)-2-(tert-butylamino)ethanol
CID 155154323
(1S)-2-(tert-butylamino)-1-[6-(trideuteriomethylamino)-2-pyridinyl]ethanol
CID 155620556
(1S)-2-(tert-butylamino)-1-(6-cyclobutyl-2-pyridinyl)ethanol;sulfane
CID 158718801
(1S)-2-(tert-butylamino)-1-quinolin-2-ylethanol;sulfane
CID 159416037
6-[(1S)-2-(tert-butylamino)-1-hydroxyethyl]-N-methylpyridine-2-carboxamide
CID 155154232
2-(tert-butylamino)-1-[5-methyl-6-(trifluoromethyl)-2-pyridinyl]ethanol
CID 155701455
(1S)-2-(tert-butylamino)-1-(6-pyrrolidin-1-yl-2-pyridinyl)ethanol;sulfane
CID 158367640
2-(tert-butylamino)-1-(6-morpholin-4-yl-2-pyridinyl)ethanol
CID 170592933
(1R)-2-(tert-butylamino)-1-(6-morpholin-4-yl-2-pyridinyl)ethanol
CID 155154273

Frequently Asked Questions

What is the IUPAC name of (1R)-2-(tert-butylamino)-1-[6-(2-methylphenyl)-2-pyridinyl]ethanol?
The IUPAC name of (1R)-2-(tert-butylamino)-1-[6-(2-methylphenyl)-2-pyridinyl]ethanol (CID 155154266) is (1R)-2-(tert-butylamino)-1-[6-(2-methylphenyl)-2-pyridinyl]ethanol.
What is the SMILES notation for (1R)-2-(tert-butylamino)-1-[6-(2-methylphenyl)-2-pyridinyl]ethanol?
The canonical SMILES for (1R)-2-(tert-butylamino)-1-[6-(2-methylphenyl)-2-pyridinyl]ethanol is Cc1ccccc1-c1cccc([C@H](O)CNC(C)(C)C)n1.
What is the InChIKey of (1R)-2-(tert-butylamino)-1-[6-(2-methylphenyl)-2-pyridinyl]ethanol?
The InChIKey is LYNMYCZREDHVQI-QGZVFWFLSA-N. The full InChI is InChI=1S/C18H24N2O/c1-13-8-5-6-9-14(13)15-10-7-11-16(20-15)17(21)12-19-18(2,3)4/h5-11,17,19,21H,12H2,1-4H3/t17-/m1/s1.
What are the key properties of (1R)-2-(tert-butylamino)-1-[6-(2-methylphenyl)-2-pyridinyl]ethanol?
(1R)-2-(tert-butylamino)-1-[6-(2-methylphenyl)-2-pyridinyl]ethanol has a molecular weight of 284.40 g/mol, XLogP of 3.48, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-2-(tert-butylamino)-1-[6-(2-methylphenyl)-2-pyridinyl]ethanol is sourced from PubChem (CID 155154266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).