4,6-di(propan-2-yl)pyrazolo[1,5-a]pyridine-5,7-diamine

C13H20N4 — CID 22180913

IUPAC4,6-di(propan-2-yl)pyrazolo[1,5-a]pyridine-5,7-diamine
SMILESCC(C)c1c(N)c(C(C)C)c2ccnn2c1N
InChIInChI=1S/C13H20N4/c1-7(2)10-9-5-6-16-17(9)13(15)11(8(3)4)12(10)14/h5-8H,14-15H2,1-4H3
InChIKeyRSFYWMBSEZGDOQ-UHFFFAOYSA-N
MW232.33 g/mol
LogP2.75
Rot. Bonds2

About 4,6-di(propan-2-yl)pyrazolo[1,5-a]pyridine-5,7-diamine

4,6-di(propan-2-yl)pyrazolo[1,5-a]pyridine-5,7-diamine (PubChem CID 22180913) has the molecular formula C13H20N4 and a molecular weight of 232.33 g/mol. Its IUPAC name is 4,6-di(propan-2-yl)pyrazolo[1,5-a]pyridine-5,7-diamine.

Molecular Properties

Compound Name4,6-di(propan-2-yl)pyrazolo[1,5-a]pyridine-5,7-diamine
PubChem CID22180913
Molecular FormulaC13H20N4
Molecular Weight232.33 g/mol
Exact Mass232.17
IUPAC Name4,6-di(propan-2-yl)pyrazolo[1,5-a]pyridine-5,7-diamine
SMILESCC(C)c1c(N)c(C(C)C)c2ccnn2c1N
InChIInChI=1S/C13H20N4/c1-7(2)10-9-5-6-16-17(9)13(15)11(8(3)4)12(10)14/h5-8H,14-15H2,1-4H3
InChIKeyRSFYWMBSEZGDOQ-UHFFFAOYSA-N
XLogP2.75
TPSA69.34 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 52.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4,6-di(propan-2-yl)pyrazolo[1,5-a]pyridine-5,7-diamine?
The IUPAC name of 4,6-di(propan-2-yl)pyrazolo[1,5-a]pyridine-5,7-diamine (CID 22180913) is 4,6-di(propan-2-yl)pyrazolo[1,5-a]pyridine-5,7-diamine.
What is the SMILES notation for 4,6-di(propan-2-yl)pyrazolo[1,5-a]pyridine-5,7-diamine?
The canonical SMILES for 4,6-di(propan-2-yl)pyrazolo[1,5-a]pyridine-5,7-diamine is CC(C)c1c(N)c(C(C)C)c2ccnn2c1N.
What is the InChIKey of 4,6-di(propan-2-yl)pyrazolo[1,5-a]pyridine-5,7-diamine?
The InChIKey is RSFYWMBSEZGDOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4/c1-7(2)10-9-5-6-16-17(9)13(15)11(8(3)4)12(10)14/h5-8H,14-15H2,1-4H3.
What are the key properties of 4,6-di(propan-2-yl)pyrazolo[1,5-a]pyridine-5,7-diamine?
4,6-di(propan-2-yl)pyrazolo[1,5-a]pyridine-5,7-diamine has a molecular weight of 232.33 g/mol, XLogP of 2.75, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-di(propan-2-yl)pyrazolo[1,5-a]pyridine-5,7-diamine is sourced from PubChem (CID 22180913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).