2-amino-2-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)ethanol

C11H16N4O — CID 83889517

IUPAC2-amino-2-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)ethanol
SMILESCC(C)c1nnc2ccc(C(N)CO)cn12
InChIInChI=1S/C11H16N4O/c1-7(2)11-14-13-10-4-3-8(5-15(10)11)9(12)6-16/h3-5,7,9,16H,6,12H2,1-2H3
InChIKeyICAQRJIXMGSDTB-UHFFFAOYSA-N
MW220.28 g/mol
LogP0.84
Rot. Bonds3

About 2-amino-2-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)ethanol

2-amino-2-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)ethanol (PubChem CID 83889517) has the molecular formula C11H16N4O and a molecular weight of 220.28 g/mol. Its IUPAC name is 2-amino-2-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)ethanol.

Molecular Properties

Compound Name2-amino-2-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)ethanol
PubChem CID83889517
Molecular FormulaC11H16N4O
Molecular Weight220.28 g/mol
Exact Mass220.13
IUPAC Name2-amino-2-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)ethanol
SMILESCC(C)c1nnc2ccc(C(N)CO)cn12
InChIInChI=1S/C11H16N4O/c1-7(2)11-14-13-10-4-3-8(5-15(10)11)9(12)6-16/h3-5,7,9,16H,6,12H2,1-2H3
InChIKeyICAQRJIXMGSDTB-UHFFFAOYSA-N
XLogP0.84
TPSA76.44 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.28
LogP ≤ 50.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-amino-2-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)ethanol with MolForge

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Related Compounds

2-amino-2-(6-bromo-[1,2,4]triazolo[4,3-a]pyridin-3-yl)ethanol
CID 65347901
2-amino-2-[6-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]ethanol
CID 43154745
2-amino-2-([1,2,4]triazolo[4,3-a]pyridin-3-yl)ethanol
CID 24695884
6-benzyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine
CID 11776952
2-amino-2-(4-propan-2-ylphenyl)ethanol;hydrochloride
CID 155487486
6-phenyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine
CID 177308311
methyl 3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxylate
CID 84614376
6-methylsulfinyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine
CID 130374155
1-(6-chloro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)ethanamine
CID 83870127
2-amino-2-(3-methyl-2-propan-2-ylbenzimidazol-5-yl)ethanol
CID 83895795
3-(3-methylimidazol-4-yl)-N-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)propanamide
CID 126767399
7-fluoro-3,6-di(propan-2-yl)-[1,2,4]triazolo[4,3-a]pyridine
CID 177049451

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)ethanol?
The IUPAC name of 2-amino-2-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)ethanol (CID 83889517) is 2-amino-2-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)ethanol.
What is the SMILES notation for 2-amino-2-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)ethanol?
The canonical SMILES for 2-amino-2-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)ethanol is CC(C)c1nnc2ccc(C(N)CO)cn12.
What is the InChIKey of 2-amino-2-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)ethanol?
The InChIKey is ICAQRJIXMGSDTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O/c1-7(2)11-14-13-10-4-3-8(5-15(10)11)9(12)6-16/h3-5,7,9,16H,6,12H2,1-2H3.
What are the key properties of 2-amino-2-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)ethanol?
2-amino-2-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)ethanol has a molecular weight of 220.28 g/mol, XLogP of 0.84, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-(3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-yl)ethanol is sourced from PubChem (CID 83889517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).