7-[(5-methyl-2-phenyltriazol-4-yl)methoxy]-2H-triazolo[4,5-b]pyridin-5-amine

C15H14N8O — CID 118950056

IUPAC7-[(5-methyl-2-phenyltriazol-4-yl)methoxy]-2H-triazolo[4,5-b]pyridin-5-amine
SMILESCc1nn(-c2ccccc2)nc1COc1cc(N)nc2n[nH]nc12
InChIInChI=1S/C15H14N8O/c1-9-11(21-23(20-9)10-5-3-2-4-6-10)8-24-12-7-13(16)17-15-14(12)18-22-19-15/h2-7H,8H2,1H3,(H3,16,17,18,19,22)
InChIKeyJBOLAMDGILAMOV-UHFFFAOYSA-N
MW322.33 g/mol
LogP1.40
Rot. Bonds4

About 7-[(5-methyl-2-phenyltriazol-4-yl)methoxy]-2H-triazolo[4,5-b]pyridin-5-amine

7-[(5-methyl-2-phenyltriazol-4-yl)methoxy]-2H-triazolo[4,5-b]pyridin-5-amine (PubChem CID 118950056) has the molecular formula C15H14N8O and a molecular weight of 322.33 g/mol. Its IUPAC name is 7-[(5-methyl-2-phenyltriazol-4-yl)methoxy]-2H-triazolo[4,5-b]pyridin-5-amine.

Molecular Properties

Compound Name7-[(5-methyl-2-phenyltriazol-4-yl)methoxy]-2H-triazolo[4,5-b]pyridin-5-amine
PubChem CID118950056
Molecular FormulaC15H14N8O
Molecular Weight322.33 g/mol
Exact Mass322.13
IUPAC Name7-[(5-methyl-2-phenyltriazol-4-yl)methoxy]-2H-triazolo[4,5-b]pyridin-5-amine
SMILESCc1nn(-c2ccccc2)nc1COc1cc(N)nc2n[nH]nc12
InChIInChI=1S/C15H14N8O/c1-9-11(21-23(20-9)10-5-3-2-4-6-10)8-24-12-7-13(16)17-15-14(12)18-22-19-15/h2-7H,8H2,1H3,(H3,16,17,18,19,22)
InChIKeyJBOLAMDGILAMOV-UHFFFAOYSA-N
XLogP1.40
TPSA120.42 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.33
LogP ≤ 51.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

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Related Compounds

7-phenylmethoxy-2H-triazolo[4,5-b]pyridin-5-amine
CID 6415548
7-[(1-phenyltriazol-4-yl)methoxy]-2H-triazolo[4,5-b]pyridin-5-amine
CID 118949632
7-[[5-(difluoromethyl)-2-phenyltriazol-4-yl]methoxy]-2H-triazolo[4,5-b]pyridin-5-amine
CID 118950274
7-((2-Fluorobenzyl)oxy)-3H-[1,2,3]triazolo[4,5-b]pyridin-5-amine
CID 126648996
7-[(2-pyrazol-1-ylphenyl)methoxy]-2H-triazolo[4,5-b]pyridin-5-amine
CID 126649120
[5-[(5-amino-2H-triazolo[4,5-b]pyridin-7-yl)oxymethyl]-2-phenyltriazol-4-yl]methanol
CID 130365899
2H-1,2,3-Triazolo(4,5-b)pyridin-5-amine, 2-(4-methoxyphenyl)-
CID 105266
7-[[2-benzyl-5-(trifluoromethyl)triazol-4-yl]methoxy]-2H-triazolo[4,5-b]pyridin-5-amine
CID 118949422
7-[[2-(3-fluorophenyl)-5-methyltriazol-4-yl]methoxy]-2H-triazolo[4,5-b]pyridin-5-amine
CID 118949625
7-[[6-(trifluoromethyl)pyridin-2-yl]methoxy]-2H-triazolo[4,5-b]pyridin-5-amine
CID 118949703
7-[[2-ethyl-5-(trifluoromethyl)pyrazol-3-yl]methoxy]-2H-triazolo[4,5-b]pyridin-5-amine
CID 118949729
7-[[2-(4-fluorophenyl)-5-methyltriazol-4-yl]methoxy]-2H-triazolo[4,5-b]pyridin-5-amine
CID 118949734

Frequently Asked Questions

What is the IUPAC name of 7-[(5-methyl-2-phenyltriazol-4-yl)methoxy]-2H-triazolo[4,5-b]pyridin-5-amine?
The IUPAC name of 7-[(5-methyl-2-phenyltriazol-4-yl)methoxy]-2H-triazolo[4,5-b]pyridin-5-amine (CID 118950056) is 7-[(5-methyl-2-phenyltriazol-4-yl)methoxy]-2H-triazolo[4,5-b]pyridin-5-amine.
What is the SMILES notation for 7-[(5-methyl-2-phenyltriazol-4-yl)methoxy]-2H-triazolo[4,5-b]pyridin-5-amine?
The canonical SMILES for 7-[(5-methyl-2-phenyltriazol-4-yl)methoxy]-2H-triazolo[4,5-b]pyridin-5-amine is Cc1nn(-c2ccccc2)nc1COc1cc(N)nc2n[nH]nc12.
What is the InChIKey of 7-[(5-methyl-2-phenyltriazol-4-yl)methoxy]-2H-triazolo[4,5-b]pyridin-5-amine?
The InChIKey is JBOLAMDGILAMOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N8O/c1-9-11(21-23(20-9)10-5-3-2-4-6-10)8-24-12-7-13(16)17-15-14(12)18-22-19-15/h2-7H,8H2,1H3,(H3,16,17,18,19,22).
What are the key properties of 7-[(5-methyl-2-phenyltriazol-4-yl)methoxy]-2H-triazolo[4,5-b]pyridin-5-amine?
7-[(5-methyl-2-phenyltriazol-4-yl)methoxy]-2H-triazolo[4,5-b]pyridin-5-amine has a molecular weight of 322.33 g/mol, XLogP of 1.40, 4 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[(5-methyl-2-phenyltriazol-4-yl)methoxy]-2H-triazolo[4,5-b]pyridin-5-amine is sourced from PubChem (CID 118950056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).