7-N-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine-2,7-diamine

C9H13N5 — CID 82555737

IUPAC7-N-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine-2,7-diamine
SMILESCC(C)Nc1ccn2nc(N)nc2c1
InChIInChI=1S/C9H13N5/c1-6(2)11-7-3-4-14-8(5-7)12-9(10)13-14/h3-6,11H,1-2H3,(H2,10,13)
InChIKeyGPVYUJIRKOIUBR-UHFFFAOYSA-N
MW191.24 g/mol
LogP1.13
Rot. Bonds2

About 7-N-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine-2,7-diamine

7-N-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine-2,7-diamine (PubChem CID 82555737) has the molecular formula C9H13N5 and a molecular weight of 191.24 g/mol. Its IUPAC name is 7-N-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine-2,7-diamine.

Molecular Properties

Compound Name7-N-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine-2,7-diamine
PubChem CID82555737
Molecular FormulaC9H13N5
Molecular Weight191.24 g/mol
Exact Mass191.12
IUPAC Name7-N-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine-2,7-diamine
SMILESCC(C)Nc1ccn2nc(N)nc2c1
InChIInChI=1S/C9H13N5/c1-6(2)11-7-3-4-14-8(5-7)12-9(10)13-14/h3-6,11H,1-2H3,(H2,10,13)
InChIKeyGPVYUJIRKOIUBR-UHFFFAOYSA-N
XLogP1.13
TPSA68.24 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.24
LogP ≤ 51.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 7-N-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine-2,7-diamine?
The IUPAC name of 7-N-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine-2,7-diamine (CID 82555737) is 7-N-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine-2,7-diamine.
What is the SMILES notation for 7-N-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine-2,7-diamine?
The canonical SMILES for 7-N-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine-2,7-diamine is CC(C)Nc1ccn2nc(N)nc2c1.
What is the InChIKey of 7-N-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine-2,7-diamine?
The InChIKey is GPVYUJIRKOIUBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N5/c1-6(2)11-7-3-4-14-8(5-7)12-9(10)13-14/h3-6,11H,1-2H3,(H2,10,13).
What are the key properties of 7-N-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine-2,7-diamine?
7-N-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine-2,7-diamine has a molecular weight of 191.24 g/mol, XLogP of 1.13, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-N-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine-2,7-diamine is sourced from PubChem (CID 82555737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).