2-N-(3-methyl-2H-indazol-5-yl)-[1,2,4]triazolo[1,5-a]pyridine-2,5-diamine

C14H13N7 — CID 141394383

IUPAC2-N-(3-methyl-2H-indazol-5-yl)-[1,2,4]triazolo[1,5-a]pyridine-2,5-diamine
SMILESCc1[nH]nc2ccc(Nc3nc4cccc(N)n4n3)cc12
InChIInChI=1S/C14H13N7/c1-8-10-7-9(5-6-11(10)19-18-8)16-14-17-13-4-2-3-12(15)21(13)20-14/h2-7H,15H2,1H3,(H,16,20)(H,18,19)
InChIKeyLZNAMETWCAQHRK-UHFFFAOYSA-N
MW279.31 g/mol
LogP2.24
Rot. Bonds2

About 2-N-(3-methyl-2H-indazol-5-yl)-[1,2,4]triazolo[1,5-a]pyridine-2,5-diamine

2-N-(3-methyl-2H-indazol-5-yl)-[1,2,4]triazolo[1,5-a]pyridine-2,5-diamine (PubChem CID 141394383) has the molecular formula C14H13N7 and a molecular weight of 279.31 g/mol. Its IUPAC name is 2-N-(3-methyl-2H-indazol-5-yl)-[1,2,4]triazolo[1,5-a]pyridine-2,5-diamine.

Molecular Properties

Compound Name2-N-(3-methyl-2H-indazol-5-yl)-[1,2,4]triazolo[1,5-a]pyridine-2,5-diamine
PubChem CID141394383
Molecular FormulaC14H13N7
Molecular Weight279.31 g/mol
Exact Mass279.12
IUPAC Name2-N-(3-methyl-2H-indazol-5-yl)-[1,2,4]triazolo[1,5-a]pyridine-2,5-diamine
SMILESCc1[nH]nc2ccc(Nc3nc4cccc(N)n4n3)cc12
InChIInChI=1S/C14H13N7/c1-8-10-7-9(5-6-11(10)19-18-8)16-14-17-13-4-2-3-12(15)21(13)20-14/h2-7H,15H2,1H3,(H,16,20)(H,18,19)
InChIKeyLZNAMETWCAQHRK-UHFFFAOYSA-N
XLogP2.24
TPSA96.92 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.31
LogP ≤ 52.24
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-N-(3-methyl-2H-indazol-5-yl)-[1,2,4]triazolo[1,5-a]pyridine-2,5-diamine?
The IUPAC name of 2-N-(3-methyl-2H-indazol-5-yl)-[1,2,4]triazolo[1,5-a]pyridine-2,5-diamine (CID 141394383) is 2-N-(3-methyl-2H-indazol-5-yl)-[1,2,4]triazolo[1,5-a]pyridine-2,5-diamine.
What is the SMILES notation for 2-N-(3-methyl-2H-indazol-5-yl)-[1,2,4]triazolo[1,5-a]pyridine-2,5-diamine?
The canonical SMILES for 2-N-(3-methyl-2H-indazol-5-yl)-[1,2,4]triazolo[1,5-a]pyridine-2,5-diamine is Cc1[nH]nc2ccc(Nc3nc4cccc(N)n4n3)cc12.
What is the InChIKey of 2-N-(3-methyl-2H-indazol-5-yl)-[1,2,4]triazolo[1,5-a]pyridine-2,5-diamine?
The InChIKey is LZNAMETWCAQHRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N7/c1-8-10-7-9(5-6-11(10)19-18-8)16-14-17-13-4-2-3-12(15)21(13)20-14/h2-7H,15H2,1H3,(H,16,20)(H,18,19).
What are the key properties of 2-N-(3-methyl-2H-indazol-5-yl)-[1,2,4]triazolo[1,5-a]pyridine-2,5-diamine?
2-N-(3-methyl-2H-indazol-5-yl)-[1,2,4]triazolo[1,5-a]pyridine-2,5-diamine has a molecular weight of 279.31 g/mol, XLogP of 2.24, 2 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(3-methyl-2H-indazol-5-yl)-[1,2,4]triazolo[1,5-a]pyridine-2,5-diamine is sourced from PubChem (CID 141394383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).