7-[(1-methylindazol-6-yl)methyl]-2H-triazolo[4,5-b]pyridin-5-amine

C14H13N7 — CID 126650381

IUPAC7-[(1-methylindazol-6-yl)methyl]-2H-triazolo[4,5-b]pyridin-5-amine
SMILESCn1ncc2ccc(Cc3cc(N)nc4n[nH]nc34)cc21
InChIInChI=1S/C14H13N7/c1-21-11-5-8(2-3-9(11)7-16-21)4-10-6-12(15)17-14-13(10)18-20-19-14/h2-3,5-7H,4H2,1H3,(H3,15,17,18,19,20)
InChIKeyDHUFAVRIZHLSFS-UHFFFAOYSA-N
MW279.31 g/mol
LogP1.41
Rot. Bonds2

About 7-[(1-methylindazol-6-yl)methyl]-2H-triazolo[4,5-b]pyridin-5-amine

7-[(1-methylindazol-6-yl)methyl]-2H-triazolo[4,5-b]pyridin-5-amine (PubChem CID 126650381) has the molecular formula C14H13N7 and a molecular weight of 279.31 g/mol. Its IUPAC name is 7-[(1-methylindazol-6-yl)methyl]-2H-triazolo[4,5-b]pyridin-5-amine.

Molecular Properties

Compound Name7-[(1-methylindazol-6-yl)methyl]-2H-triazolo[4,5-b]pyridin-5-amine
PubChem CID126650381
Molecular FormulaC14H13N7
Molecular Weight279.31 g/mol
Exact Mass279.12
IUPAC Name7-[(1-methylindazol-6-yl)methyl]-2H-triazolo[4,5-b]pyridin-5-amine
SMILESCn1ncc2ccc(Cc3cc(N)nc4n[nH]nc34)cc21
InChIInChI=1S/C14H13N7/c1-21-11-5-8(2-3-9(11)7-16-21)4-10-6-12(15)17-14-13(10)18-20-19-14/h2-3,5-7H,4H2,1H3,(H3,15,17,18,19,20)
InChIKeyDHUFAVRIZHLSFS-UHFFFAOYSA-N
XLogP1.41
TPSA98.30 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.31
LogP ≤ 51.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

7-[(4-methoxyphenyl)methyl]-2H-triazolo[4,5-b]pyridin-5-amine
CID 135341277
7-(cyclodecapentaenylmethyl)-2H-triazolo[4,5-b]pyridin-5-amine
CID 126676489
7-[[1-(6-methyl-2-pyridinyl)pyrazol-4-yl]methyl]-2H-triazolo[4,5-b]pyridin-5-amine
CID 126676279
7-ethyl-2H-triazolo[4,5-b]pyridin-5-amine
CID 126676575
7-[[1-(3-cyclopropylphenyl)pyrazol-4-yl]methyl]-2H-triazolo[4,5-b]pyridin-5-amine
CID 126649364
ethane;(1-methylindazol-6-yl)methanol
CID 168921165
7-[[1-[(3-pyridin-3-ylphenyl)methyl]pyrazol-4-yl]methyl]-2H-triazolo[4,5-b]pyridin-5-amine
CID 126675532
2-[(1-methylindazol-6-yl)methyl]guanidine;hydrobromide
CID 154861967
7-[[1-[(3-pyridin-2-ylphenyl)methyl]pyrazol-4-yl]methyl]-2H-triazolo[4,5-b]pyridin-5-amine
CID 126675681
2-(1-methylindazol-6-yl)acetonitrile
CID 84765976
7-[[1-[(3-benzylphenyl)methyl]pyrazol-3-yl]methyl]-2H-triazolo[4,5-b]pyridin-5-amine
CID 164629204
6-[[2,6-bis(2,5-dimethylpyrrol-1-yl)-4-pyridinyl]methyl]-1-methylindazole
CID 126677790

Frequently Asked Questions

What is the IUPAC name of 7-[(1-methylindazol-6-yl)methyl]-2H-triazolo[4,5-b]pyridin-5-amine?
The IUPAC name of 7-[(1-methylindazol-6-yl)methyl]-2H-triazolo[4,5-b]pyridin-5-amine (CID 126650381) is 7-[(1-methylindazol-6-yl)methyl]-2H-triazolo[4,5-b]pyridin-5-amine.
What is the SMILES notation for 7-[(1-methylindazol-6-yl)methyl]-2H-triazolo[4,5-b]pyridin-5-amine?
The canonical SMILES for 7-[(1-methylindazol-6-yl)methyl]-2H-triazolo[4,5-b]pyridin-5-amine is Cn1ncc2ccc(Cc3cc(N)nc4n[nH]nc34)cc21.
What is the InChIKey of 7-[(1-methylindazol-6-yl)methyl]-2H-triazolo[4,5-b]pyridin-5-amine?
The InChIKey is DHUFAVRIZHLSFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N7/c1-21-11-5-8(2-3-9(11)7-16-21)4-10-6-12(15)17-14-13(10)18-20-19-14/h2-3,5-7H,4H2,1H3,(H3,15,17,18,19,20).
What are the key properties of 7-[(1-methylindazol-6-yl)methyl]-2H-triazolo[4,5-b]pyridin-5-amine?
7-[(1-methylindazol-6-yl)methyl]-2H-triazolo[4,5-b]pyridin-5-amine has a molecular weight of 279.31 g/mol, XLogP of 1.41, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[(1-methylindazol-6-yl)methyl]-2H-triazolo[4,5-b]pyridin-5-amine is sourced from PubChem (CID 126650381), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).