2-amino-2-(3-cyclopropyl-[1,2,4]triazolo[4,3-a]pyridin-5-yl)ethanol

C11H14N4O — CID 83888161

IUPAC2-amino-2-(3-cyclopropyl-[1,2,4]triazolo[4,3-a]pyridin-5-yl)ethanol
SMILESNC(CO)c1cccc2nnc(C3CC3)n12
InChIInChI=1S/C11H14N4O/c12-8(6-16)9-2-1-3-10-13-14-11(15(9)10)7-4-5-7/h1-3,7-8,16H,4-6,12H2
InChIKeyZZWIMJPIKSSKHO-UHFFFAOYSA-N
MW218.26 g/mol
LogP0.60
Rot. Bonds3

About 2-amino-2-(3-cyclopropyl-[1,2,4]triazolo[4,3-a]pyridin-5-yl)ethanol

2-amino-2-(3-cyclopropyl-[1,2,4]triazolo[4,3-a]pyridin-5-yl)ethanol (PubChem CID 83888161) has the molecular formula C11H14N4O and a molecular weight of 218.26 g/mol. Its IUPAC name is 2-amino-2-(3-cyclopropyl-[1,2,4]triazolo[4,3-a]pyridin-5-yl)ethanol.

Molecular Properties

Compound Name2-amino-2-(3-cyclopropyl-[1,2,4]triazolo[4,3-a]pyridin-5-yl)ethanol
PubChem CID83888161
Molecular FormulaC11H14N4O
Molecular Weight218.26 g/mol
Exact Mass218.12
IUPAC Name2-amino-2-(3-cyclopropyl-[1,2,4]triazolo[4,3-a]pyridin-5-yl)ethanol
SMILESNC(CO)c1cccc2nnc(C3CC3)n12
InChIInChI=1S/C11H14N4O/c12-8(6-16)9-2-1-3-10-13-14-11(15(9)10)7-4-5-7/h1-3,7-8,16H,4-6,12H2
InChIKeyZZWIMJPIKSSKHO-UHFFFAOYSA-N
XLogP0.60
TPSA76.44 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 50.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-cyclopropyl-[1,2,4]triazolo[4,3-a]pyridine-5-carboxylic acid
CID 83686835
5-bromo-3-cyclobutyl-[1,2,4]triazolo[4,3-a]pyridine
CID 83900543
3-(oxetan-3-yl)-5-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine
CID 177167527
2-(3-cyclobutyl-[1,2,4]triazolo[4,3-a]pyridin-5-yl)ethanamine
CID 83866670
3-cyclopentyl-5-methyl-[1,2,4]triazolo[4,3-a]pyridine
CID 117142344
2-amino-2-([1,2,4]triazolo[4,3-a]pyridin-3-yl)ethanol
CID 24695884
3-(1,1-dioxothiolan-3-yl)-[1,2,4]triazolo[4,3-a]pyridine-5-carboxylic acid
CID 117142451
3-(1,1-dioxothiolan-3-yl)-[1,2,4]triazolo[4,3-a]pyridin-5-amine
CID 117141245
3-cyclohexyl-5-methoxy-[1,2,4]triazolo[4,3-a]pyridine
CID 117140658
methyl 3-(1,1-dioxothian-4-yl)-[1,2,4]triazolo[4,3-a]pyridine-5-carboxylate
CID 117142477
3-(1-ethylpiperidin-4-yl)-5-methoxy-[1,2,4]triazolo[4,3-a]pyridine
CID 117140421
2-amino-2-(3-cyclopropylimidazo[1,5-a]pyridin-5-yl)acetic acid
CID 83840685

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-(3-cyclopropyl-[1,2,4]triazolo[4,3-a]pyridin-5-yl)ethanol?
The IUPAC name of 2-amino-2-(3-cyclopropyl-[1,2,4]triazolo[4,3-a]pyridin-5-yl)ethanol (CID 83888161) is 2-amino-2-(3-cyclopropyl-[1,2,4]triazolo[4,3-a]pyridin-5-yl)ethanol.
What is the SMILES notation for 2-amino-2-(3-cyclopropyl-[1,2,4]triazolo[4,3-a]pyridin-5-yl)ethanol?
The canonical SMILES for 2-amino-2-(3-cyclopropyl-[1,2,4]triazolo[4,3-a]pyridin-5-yl)ethanol is NC(CO)c1cccc2nnc(C3CC3)n12.
What is the InChIKey of 2-amino-2-(3-cyclopropyl-[1,2,4]triazolo[4,3-a]pyridin-5-yl)ethanol?
The InChIKey is ZZWIMJPIKSSKHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4O/c12-8(6-16)9-2-1-3-10-13-14-11(15(9)10)7-4-5-7/h1-3,7-8,16H,4-6,12H2.
What are the key properties of 2-amino-2-(3-cyclopropyl-[1,2,4]triazolo[4,3-a]pyridin-5-yl)ethanol?
2-amino-2-(3-cyclopropyl-[1,2,4]triazolo[4,3-a]pyridin-5-yl)ethanol has a molecular weight of 218.26 g/mol, XLogP of 0.60, 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-cyclopropyl-[1,2,4]triazolo[4,3-a]pyridin-5-yl)ethanol is sourced from PubChem (CID 83888161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).