3-methyl-1-(2-methylpropyl)-5-pyridin-4-ylpyrazolo[5,4-b]pyridine

C16H18N4 — CID 20507725

IUPAC3-methyl-1-(2-methylpropyl)-5-pyridin-4-ylpyrazolo[5,4-b]pyridine
SMILESCc1nn(CC(C)C)c2ncc(-c3ccncc3)cc12
InChIInChI=1S/C16H18N4/c1-11(2)10-20-16-15(12(3)19-20)8-14(9-18-16)13-4-6-17-7-5-13/h4-9,11H,10H2,1-3H3
InChIKeyDKGVRYJHCVFXJB-UHFFFAOYSA-N
MW266.35 g/mol
LogP3.46
Rot. Bonds3

About 3-methyl-1-(2-methylpropyl)-5-pyridin-4-ylpyrazolo[5,4-b]pyridine

3-methyl-1-(2-methylpropyl)-5-pyridin-4-ylpyrazolo[5,4-b]pyridine (PubChem CID 20507725) has the molecular formula C16H18N4 and a molecular weight of 266.35 g/mol. Its IUPAC name is 3-methyl-1-(2-methylpropyl)-5-pyridin-4-ylpyrazolo[5,4-b]pyridine.

Molecular Properties

Compound Name3-methyl-1-(2-methylpropyl)-5-pyridin-4-ylpyrazolo[5,4-b]pyridine
PubChem CID20507725
Molecular FormulaC16H18N4
Molecular Weight266.35 g/mol
Exact Mass266.15
IUPAC Name3-methyl-1-(2-methylpropyl)-5-pyridin-4-ylpyrazolo[5,4-b]pyridine
SMILESCc1nn(CC(C)C)c2ncc(-c3ccncc3)cc12
InChIInChI=1S/C16H18N4/c1-11(2)10-20-16-15(12(3)19-20)8-14(9-18-16)13-4-6-17-7-5-13/h4-9,11H,10H2,1-3H3
InChIKeyDKGVRYJHCVFXJB-UHFFFAOYSA-N
XLogP3.46
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.35
LogP ≤ 53.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-1-(2-methylpropyl)-5-pyridin-4-ylpyrazolo[5,4-b]pyridine?
The IUPAC name of 3-methyl-1-(2-methylpropyl)-5-pyridin-4-ylpyrazolo[5,4-b]pyridine (CID 20507725) is 3-methyl-1-(2-methylpropyl)-5-pyridin-4-ylpyrazolo[5,4-b]pyridine.
What is the SMILES notation for 3-methyl-1-(2-methylpropyl)-5-pyridin-4-ylpyrazolo[5,4-b]pyridine?
The canonical SMILES for 3-methyl-1-(2-methylpropyl)-5-pyridin-4-ylpyrazolo[5,4-b]pyridine is Cc1nn(CC(C)C)c2ncc(-c3ccncc3)cc12.
What is the InChIKey of 3-methyl-1-(2-methylpropyl)-5-pyridin-4-ylpyrazolo[5,4-b]pyridine?
The InChIKey is DKGVRYJHCVFXJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N4/c1-11(2)10-20-16-15(12(3)19-20)8-14(9-18-16)13-4-6-17-7-5-13/h4-9,11H,10H2,1-3H3.
What are the key properties of 3-methyl-1-(2-methylpropyl)-5-pyridin-4-ylpyrazolo[5,4-b]pyridine?
3-methyl-1-(2-methylpropyl)-5-pyridin-4-ylpyrazolo[5,4-b]pyridine has a molecular weight of 266.35 g/mol, XLogP of 3.46, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1-(2-methylpropyl)-5-pyridin-4-ylpyrazolo[5,4-b]pyridine is sourced from PubChem (CID 20507725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).