7-[(1-phenyltriazol-4-yl)methoxy]-2H-triazolo[4,5-b]pyridin-5-amine

C14H12N8O — CID 118949632

IUPAC7-[(1-phenyltriazol-4-yl)methoxy]-2H-triazolo[4,5-b]pyridin-5-amine
SMILESNc1cc(OCc2cn(-c3ccccc3)nn2)c2n[nH]nc2n1
InChIInChI=1S/C14H12N8O/c15-12-6-11(13-14(16-12)19-20-18-13)23-8-9-7-22(21-17-9)10-4-2-1-3-5-10/h1-7H,8H2,(H3,15,16,18,19,20)
InChIKeyFTFQUYQJLVOYPS-UHFFFAOYSA-N
MW308.31 g/mol
LogP1.09
Rot. Bonds4

About 7-[(1-phenyltriazol-4-yl)methoxy]-2H-triazolo[4,5-b]pyridin-5-amine

7-[(1-phenyltriazol-4-yl)methoxy]-2H-triazolo[4,5-b]pyridin-5-amine (PubChem CID 118949632) has the molecular formula C14H12N8O and a molecular weight of 308.31 g/mol. Its IUPAC name is 7-[(1-phenyltriazol-4-yl)methoxy]-2H-triazolo[4,5-b]pyridin-5-amine.

Molecular Properties

Compound Name7-[(1-phenyltriazol-4-yl)methoxy]-2H-triazolo[4,5-b]pyridin-5-amine
PubChem CID118949632
Molecular FormulaC14H12N8O
Molecular Weight308.31 g/mol
Exact Mass308.11
IUPAC Name7-[(1-phenyltriazol-4-yl)methoxy]-2H-triazolo[4,5-b]pyridin-5-amine
SMILESNc1cc(OCc2cn(-c3ccccc3)nn2)c2n[nH]nc2n1
InChIInChI=1S/C14H12N8O/c15-12-6-11(13-14(16-12)19-20-18-13)23-8-9-7-22(21-17-9)10-4-2-1-3-5-10/h1-7H,8H2,(H3,15,16,18,19,20)
InChIKeyFTFQUYQJLVOYPS-UHFFFAOYSA-N
XLogP1.09
TPSA120.42 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.31
LogP ≤ 51.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

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Related Compounds

7-{[3-(1-methyl-1H-pyrazol-3-yl)phenyl]methoxy}-1H-[1,2,3]triazolo[4,5-b]pyridin-5-amine
CID 126648929
7-phenylmethoxy-2H-triazolo[4,5-b]pyridin-5-amine
CID 6415548
7-[(5-methyl-2-phenyltriazol-4-yl)methoxy]-2H-triazolo[4,5-b]pyridin-5-amine
CID 118950056
7-[[5-(difluoromethyl)-2-phenyltriazol-4-yl]methoxy]-2H-triazolo[4,5-b]pyridin-5-amine
CID 118950274
7-[[3-(1-methylpyrazol-4-yl)phenyl]methoxy]-2H-triazolo[4,5-b]pyridin-5-amine
CID 126648798
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
7-Methoxy-3H-[1,2,3]triazolo[4,5-b]pyridine
CID 59949768
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-[[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-[(1-phenyltriazol-4-yl)methoxy]-2H-triazolo[4,5-b]pyridin-5-amine?
The IUPAC name of 7-[(1-phenyltriazol-4-yl)methoxy]-2H-triazolo[4,5-b]pyridin-5-amine (CID 118949632) is 7-[(1-phenyltriazol-4-yl)methoxy]-2H-triazolo[4,5-b]pyridin-5-amine.
What is the SMILES notation for 7-[(1-phenyltriazol-4-yl)methoxy]-2H-triazolo[4,5-b]pyridin-5-amine?
The canonical SMILES for 7-[(1-phenyltriazol-4-yl)methoxy]-2H-triazolo[4,5-b]pyridin-5-amine is Nc1cc(OCc2cn(-c3ccccc3)nn2)c2n[nH]nc2n1.
What is the InChIKey of 7-[(1-phenyltriazol-4-yl)methoxy]-2H-triazolo[4,5-b]pyridin-5-amine?
The InChIKey is FTFQUYQJLVOYPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N8O/c15-12-6-11(13-14(16-12)19-20-18-13)23-8-9-7-22(21-17-9)10-4-2-1-3-5-10/h1-7H,8H2,(H3,15,16,18,19,20).
What are the key properties of 7-[(1-phenyltriazol-4-yl)methoxy]-2H-triazolo[4,5-b]pyridin-5-amine?
7-[(1-phenyltriazol-4-yl)methoxy]-2H-triazolo[4,5-b]pyridin-5-amine has a molecular weight of 308.31 g/mol, XLogP of 1.09, 4 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[(1-phenyltriazol-4-yl)methoxy]-2H-triazolo[4,5-b]pyridin-5-amine is sourced from PubChem (CID 118949632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).