[4-[[5-(1-ethylpyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-2-pyridinyl]methanol

C17H17N7O — CID 59186263

IUPAC[4-[[5-(1-ethylpyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-2-pyridinyl]methanol
SMILESCCn1cc(-c2cccc3nc(Nc4ccnc(CO)c4)nn23)cn1
InChIInChI=1S/C17H17N7O/c1-2-23-10-12(9-19-23)15-4-3-5-16-21-17(22-24(15)16)20-13-6-7-18-14(8-13)11-25/h3-10,25H,2,11H2,1H3,(H,18,20,22)
InChIKeyIHOZCQOCOSYTJT-UHFFFAOYSA-N
MW335.37 g/mol
LogP2.24
Rot. Bonds5

About [4-[[5-(1-ethylpyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-2-pyridinyl]methanol

[4-[[5-(1-ethylpyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-2-pyridinyl]methanol (PubChem CID 59186263) has the molecular formula C17H17N7O and a molecular weight of 335.37 g/mol. Its IUPAC name is [4-[[5-(1-ethylpyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-2-pyridinyl]methanol.

Molecular Properties

Compound Name[4-[[5-(1-ethylpyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-2-pyridinyl]methanol
PubChem CID59186263
Molecular FormulaC17H17N7O
Molecular Weight335.37 g/mol
Exact Mass335.15
IUPAC Name[4-[[5-(1-ethylpyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-2-pyridinyl]methanol
SMILESCCn1cc(-c2cccc3nc(Nc4ccnc(CO)c4)nn23)cn1
InChIInChI=1S/C17H17N7O/c1-2-23-10-12(9-19-23)15-4-3-5-16-21-17(22-24(15)16)20-13-6-7-18-14(8-13)11-25/h3-10,25H,2,11H2,1H3,(H,18,20,22)
InChIKeyIHOZCQOCOSYTJT-UHFFFAOYSA-N
XLogP2.24
TPSA93.16 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.37
LogP ≤ 52.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of [4-[[5-(1-ethylpyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-2-pyridinyl]methanol?
The IUPAC name of [4-[[5-(1-ethylpyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-2-pyridinyl]methanol (CID 59186263) is [4-[[5-(1-ethylpyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-2-pyridinyl]methanol.
What is the SMILES notation for [4-[[5-(1-ethylpyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-2-pyridinyl]methanol?
The canonical SMILES for [4-[[5-(1-ethylpyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-2-pyridinyl]methanol is CCn1cc(-c2cccc3nc(Nc4ccnc(CO)c4)nn23)cn1.
What is the InChIKey of [4-[[5-(1-ethylpyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-2-pyridinyl]methanol?
The InChIKey is IHOZCQOCOSYTJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N7O/c1-2-23-10-12(9-19-23)15-4-3-5-16-21-17(22-24(15)16)20-13-6-7-18-14(8-13)11-25/h3-10,25H,2,11H2,1H3,(H,18,20,22).
What are the key properties of [4-[[5-(1-ethylpyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-2-pyridinyl]methanol?
[4-[[5-(1-ethylpyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-2-pyridinyl]methanol has a molecular weight of 335.37 g/mol, XLogP of 2.24, 5 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[[5-(1-ethylpyrazol-4-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]amino]-2-pyridinyl]methanol is sourced from PubChem (CID 59186263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).