3-[(6-fluoro-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]-4,4-dimethylpentan-1-ol

C13H19FN4O — CID 106350714

IUPAC3-[(6-fluoro-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]-4,4-dimethylpentan-1-ol
SMILESCC(C)(C)C(CCO)Nc1nc2ccc(F)cn2n1
InChIInChI=1S/C13H19FN4O/c1-13(2,3)10(6-7-19)15-12-16-11-5-4-9(14)8-18(11)17-12/h4-5,8,10,19H,6-7H2,1-3H3,(H,15,17)
InChIKeyBOVVFUWOMXMYDI-UHFFFAOYSA-N
MW266.32 g/mol
LogP2.08
Rot. Bonds4

About 3-[(6-fluoro-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]-4,4-dimethylpentan-1-ol

3-[(6-fluoro-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]-4,4-dimethylpentan-1-ol (PubChem CID 106350714) has the molecular formula C13H19FN4O and a molecular weight of 266.32 g/mol. Its IUPAC name is 3-[(6-fluoro-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]-4,4-dimethylpentan-1-ol.

Molecular Properties

Compound Name3-[(6-fluoro-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]-4,4-dimethylpentan-1-ol
PubChem CID106350714
Molecular FormulaC13H19FN4O
Molecular Weight266.32 g/mol
Exact Mass266.15
IUPAC Name3-[(6-fluoro-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]-4,4-dimethylpentan-1-ol
SMILESCC(C)(C)C(CCO)Nc1nc2ccc(F)cn2n1
InChIInChI=1S/C13H19FN4O/c1-13(2,3)10(6-7-19)15-12-16-11-5-4-9(14)8-18(11)17-12/h4-5,8,10,19H,6-7H2,1-3H3,(H,15,17)
InChIKeyBOVVFUWOMXMYDI-UHFFFAOYSA-N
XLogP2.08
TPSA62.45 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.32
LogP ≤ 52.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 3-[(6-fluoro-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]-4,4-dimethylpentan-1-ol with MolForge

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Related Compounds

6-fluoro-N-(4-methylpent-1-yn-3-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine
CID 114202601
3-[(6-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]butan-1-ol
CID 83187344
6-[(6-fluoro-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]hexan-1-ol
CID 107850356
6-fluoro-N-octan-4-yl-[1,2,4]triazolo[1,5-a]pyridin-2-amine
CID 106026408
6-fluoro-N-(3-methylpentan-3-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine
CID 114174358
2-N-(6-fluoro-[1,2,4]triazolo[1,5-a]pyridin-2-yl)hexane-1,2-diamine
CID 80698401
2-N-(6-fluoro-[1,2,4]triazolo[1,5-a]pyridin-2-yl)-2,3-dimethylbutane-1,2-diamine
CID 115310784
N-[1-(4-aminophenyl)ethyl]-6-fluoro-[1,2,4]triazolo[1,5-a]pyridin-2-amine
CID 116650552
1-[(6-fluoro-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]-4-methoxy-2-methylbutan-2-ol
CID 106257640
N-[(1,3-dimethylpyrazol-4-yl)methyl]-6-fluoro-[1,2,4]triazolo[1,5-a]pyridin-2-amine
CID 112670728
3-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-4,4-dimethylpentan-1-ol
CID 106352606
6-fluoro-N-(2-thiomorpholin-4-ylethyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine
CID 106326077

Frequently Asked Questions

What is the IUPAC name of 3-[(6-fluoro-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]-4,4-dimethylpentan-1-ol?
The IUPAC name of 3-[(6-fluoro-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]-4,4-dimethylpentan-1-ol (CID 106350714) is 3-[(6-fluoro-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]-4,4-dimethylpentan-1-ol.
What is the SMILES notation for 3-[(6-fluoro-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]-4,4-dimethylpentan-1-ol?
The canonical SMILES for 3-[(6-fluoro-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]-4,4-dimethylpentan-1-ol is CC(C)(C)C(CCO)Nc1nc2ccc(F)cn2n1.
What is the InChIKey of 3-[(6-fluoro-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]-4,4-dimethylpentan-1-ol?
The InChIKey is BOVVFUWOMXMYDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19FN4O/c1-13(2,3)10(6-7-19)15-12-16-11-5-4-9(14)8-18(11)17-12/h4-5,8,10,19H,6-7H2,1-3H3,(H,15,17).
What are the key properties of 3-[(6-fluoro-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]-4,4-dimethylpentan-1-ol?
3-[(6-fluoro-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]-4,4-dimethylpentan-1-ol has a molecular weight of 266.32 g/mol, XLogP of 2.08, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(6-fluoro-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]-4,4-dimethylpentan-1-ol is sourced from PubChem (CID 106350714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).