7-[(2-methyl-4-pyridin-3-ylphenyl)methoxy]-2H-triazolo[4,5-b]pyridin-5-amine

C18H16N6O — CID 160912493

IUPAC7-[(2-methyl-4-pyridin-3-ylphenyl)methoxy]-2H-triazolo[4,5-b]pyridin-5-amine
SMILESCc1cc(-c2cccnc2)ccc1COc1cc(N)nc2n[nH]nc12
InChIInChI=1S/C18H16N6O/c1-11-7-12(13-3-2-6-20-9-13)4-5-14(11)10-25-15-8-16(19)21-18-17(15)22-24-23-18/h2-9H,10H2,1H3,(H3,19,21,22,23,24)
InChIKeySQYZUBQKXFHADP-UHFFFAOYSA-N
MW332.37 g/mol
LogP2.88
Rot. Bonds4

About 7-[(2-methyl-4-pyridin-3-ylphenyl)methoxy]-2H-triazolo[4,5-b]pyridin-5-amine

7-[(2-methyl-4-pyridin-3-ylphenyl)methoxy]-2H-triazolo[4,5-b]pyridin-5-amine (PubChem CID 160912493) has the molecular formula C18H16N6O and a molecular weight of 332.37 g/mol. Its IUPAC name is 7-[(2-methyl-4-pyridin-3-ylphenyl)methoxy]-2H-triazolo[4,5-b]pyridin-5-amine.

Molecular Properties

Compound Name7-[(2-methyl-4-pyridin-3-ylphenyl)methoxy]-2H-triazolo[4,5-b]pyridin-5-amine
PubChem CID160912493
Molecular FormulaC18H16N6O
Molecular Weight332.37 g/mol
Exact Mass332.14
IUPAC Name7-[(2-methyl-4-pyridin-3-ylphenyl)methoxy]-2H-triazolo[4,5-b]pyridin-5-amine
SMILESCc1cc(-c2cccnc2)ccc1COc1cc(N)nc2n[nH]nc12
InChIInChI=1S/C18H16N6O/c1-11-7-12(13-3-2-6-20-9-13)4-5-14(11)10-25-15-8-16(19)21-18-17(15)22-24-23-18/h2-9H,10H2,1H3,(H3,19,21,22,23,24)
InChIKeySQYZUBQKXFHADP-UHFFFAOYSA-N
XLogP2.88
TPSA102.60 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.37
LogP ≤ 52.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

7-[[2-methyl-4-(4-methylimidazol-1-yl)phenyl]methoxy]-2H-triazolo[4,5-b]pyridin-5-amine
CID 159251011
7-[[3-(4-phenylphenyl)phenyl]methoxy]-2H-triazolo[4,5-b]pyridin-5-amine
CID 126649018
7-[[3-(5-fluoro-3-pyridinyl)-2-methylphenyl]methoxy]-2H-triazolo[4,5-b]pyridin-5-amine
CID 126649157
[5-[4-[(5-amino-2H-triazolo[4,5-b]pyridin-7-yl)oxymethyl]-3-(trifluoromethoxy)phenyl]-2-pyridinyl]methanol
CID 126680018
7-[[2-fluoro-3-(3-fluorophenyl)phenyl]methoxy]-2H-triazolo[4,5-b]pyridin-5-amine
CID 126649071
5-[6-(4-acetylpiperazin-1-yl)-3-pyridinyl]-2-[(5-amino-2H-triazolo[4,5-b]pyridin-7-yl)oxymethyl]benzonitrile
CID 126680434
7-[[1-[(3-pyridin-3-ylphenyl)methyl]pyrazol-4-yl]methyl]-2H-triazolo[4,5-b]pyridin-5-amine
CID 126675532
7-[[3-(2-chlorophenyl)phenyl]methoxy]-2H-triazolo[4,5-b]pyridin-5-amine
CID 126648893
7-[[3-(4-methylimidazol-1-yl)phenyl]methoxy]-2H-triazolo[4,5-b]pyridin-5-amine
CID 126649084
7-[[2,6-difluoro-3-(2-methoxyphenyl)phenyl]methoxy]-2H-triazolo[4,5-b]pyridin-5-amine
CID 126648804
7-[(5-cyclopropyloxy-2-isocyanophenyl)methoxy]-2H-triazolo[4,5-b]pyridin-5-amine
CID 140901817
2,3-dimethyl-5-pyridin-3-ylpyridine
CID 122608541

Frequently Asked Questions

What is the IUPAC name of 7-[(2-methyl-4-pyridin-3-ylphenyl)methoxy]-2H-triazolo[4,5-b]pyridin-5-amine?
The IUPAC name of 7-[(2-methyl-4-pyridin-3-ylphenyl)methoxy]-2H-triazolo[4,5-b]pyridin-5-amine (CID 160912493) is 7-[(2-methyl-4-pyridin-3-ylphenyl)methoxy]-2H-triazolo[4,5-b]pyridin-5-amine.
What is the SMILES notation for 7-[(2-methyl-4-pyridin-3-ylphenyl)methoxy]-2H-triazolo[4,5-b]pyridin-5-amine?
The canonical SMILES for 7-[(2-methyl-4-pyridin-3-ylphenyl)methoxy]-2H-triazolo[4,5-b]pyridin-5-amine is Cc1cc(-c2cccnc2)ccc1COc1cc(N)nc2n[nH]nc12.
What is the InChIKey of 7-[(2-methyl-4-pyridin-3-ylphenyl)methoxy]-2H-triazolo[4,5-b]pyridin-5-amine?
The InChIKey is SQYZUBQKXFHADP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N6O/c1-11-7-12(13-3-2-6-20-9-13)4-5-14(11)10-25-15-8-16(19)21-18-17(15)22-24-23-18/h2-9H,10H2,1H3,(H3,19,21,22,23,24).
What are the key properties of 7-[(2-methyl-4-pyridin-3-ylphenyl)methoxy]-2H-triazolo[4,5-b]pyridin-5-amine?
7-[(2-methyl-4-pyridin-3-ylphenyl)methoxy]-2H-triazolo[4,5-b]pyridin-5-amine has a molecular weight of 332.37 g/mol, XLogP of 2.88, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[(2-methyl-4-pyridin-3-ylphenyl)methoxy]-2H-triazolo[4,5-b]pyridin-5-amine is sourced from PubChem (CID 160912493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).