[1-[[(8-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]methyl]cyclohexyl]methanol

C14H19BrN4O — CID 103967250

IUPAC[1-[[(8-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]methyl]cyclohexyl]methanol
SMILESOCC1(CNc2nc3c(Br)cccn3n2)CCCCC1
InChIInChI=1S/C14H19BrN4O/c15-11-5-4-8-19-12(11)17-13(18-19)16-9-14(10-20)6-2-1-3-7-14/h4-5,8,20H,1-3,6-7,9-10H2,(H,16,18)
InChIKeyVRPJPVKUWPOGSX-UHFFFAOYSA-N
MW339.24 g/mol
LogP2.85
Rot. Bonds4

About [1-[[(8-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]methyl]cyclohexyl]methanol

[1-[[(8-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]methyl]cyclohexyl]methanol (PubChem CID 103967250) has the molecular formula C14H19BrN4O and a molecular weight of 339.24 g/mol. Its IUPAC name is [1-[[(8-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]methyl]cyclohexyl]methanol.

Molecular Properties

Compound Name[1-[[(8-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]methyl]cyclohexyl]methanol
PubChem CID103967250
Molecular FormulaC14H19BrN4O
Molecular Weight339.24 g/mol
Exact Mass338.07
IUPAC Name[1-[[(8-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]methyl]cyclohexyl]methanol
SMILESOCC1(CNc2nc3c(Br)cccn3n2)CCCCC1
InChIInChI=1S/C14H19BrN4O/c15-11-5-4-8-19-12(11)17-13(18-19)16-9-14(10-20)6-2-1-3-7-14/h4-5,8,20H,1-3,6-7,9-10H2,(H,16,18)
InChIKeyVRPJPVKUWPOGSX-UHFFFAOYSA-N
XLogP2.85
TPSA62.45 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.24
LogP ≤ 52.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze [1-[[(8-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]methyl]cyclohexyl]methanol with MolForge

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Related Compounds

[1-[([1,2,4]triazolo[1,5-a]pyridin-2-ylamino)methyl]cyclohexyl]methanol
CID 103967223
8-bromo-N-[(1-methylsulfanylcyclopropyl)methyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine
CID 114116773
3-[[(8-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]methyl]-2-methyloxolan-3-ol
CID 106102508
[1-[[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]methyl]cyclohexyl]methanol
CID 103967254
2-bromo-6-[[1-(hydroxymethyl)cyclohexyl]methylamino]benzonitrile
CID 114881316
8-bromo-N-(2-phenylpropyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine
CID 104591764
2-[(8-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]ethylurea
CID 83112416
8-bromo-N-[2-(1-methylpyrazol-4-yl)ethyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine
CID 80688703
8-bromo-N-(4,4,4-trifluorobutyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine
CID 113327789
[1-[[(3-bromo-4-pyridinyl)amino]methyl]cyclohexyl]methanol
CID 104777217
[1-[[(6-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]methyl]cyclopropyl]methanol
CID 113313323
[1-[[(5-bromo-2-hydrazinylpyrimidin-4-yl)amino]methyl]cyclohexyl]methanol
CID 103968793

Frequently Asked Questions

What is the IUPAC name of [1-[[(8-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]methyl]cyclohexyl]methanol?
The IUPAC name of [1-[[(8-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]methyl]cyclohexyl]methanol (CID 103967250) is [1-[[(8-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]methyl]cyclohexyl]methanol.
What is the SMILES notation for [1-[[(8-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]methyl]cyclohexyl]methanol?
The canonical SMILES for [1-[[(8-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]methyl]cyclohexyl]methanol is OCC1(CNc2nc3c(Br)cccn3n2)CCCCC1.
What is the InChIKey of [1-[[(8-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]methyl]cyclohexyl]methanol?
The InChIKey is VRPJPVKUWPOGSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19BrN4O/c15-11-5-4-8-19-12(11)17-13(18-19)16-9-14(10-20)6-2-1-3-7-14/h4-5,8,20H,1-3,6-7,9-10H2,(H,16,18).
What are the key properties of [1-[[(8-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]methyl]cyclohexyl]methanol?
[1-[[(8-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]methyl]cyclohexyl]methanol has a molecular weight of 339.24 g/mol, XLogP of 2.85, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[[(8-bromo-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]methyl]cyclohexyl]methanol is sourced from PubChem (CID 103967250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).