7-pentyl-1H-pyrazolo[4,3-b]pyridine

C11H15N3 — CID 68626923

IUPAC7-pentyl-1H-pyrazolo[4,3-b]pyridine
SMILESCCCCCc1ccnc2cn[nH]c12
InChIInChI=1S/C11H15N3/c1-2-3-4-5-9-6-7-12-10-8-13-14-11(9)10/h6-8H,2-5H2,1H3,(H,13,14)
InChIKeyVWMPOKXRZVUICU-UHFFFAOYSA-N
MW189.26 g/mol
LogP2.69
Rot. Bonds4

About 7-pentyl-1H-pyrazolo[4,3-b]pyridine

7-pentyl-1H-pyrazolo[4,3-b]pyridine (PubChem CID 68626923) has the molecular formula C11H15N3 and a molecular weight of 189.26 g/mol. Its IUPAC name is 7-pentyl-1H-pyrazolo[4,3-b]pyridine.

Molecular Properties

Compound Name7-pentyl-1H-pyrazolo[4,3-b]pyridine
PubChem CID68626923
Molecular FormulaC11H15N3
Molecular Weight189.26 g/mol
Exact Mass189.13
IUPAC Name7-pentyl-1H-pyrazolo[4,3-b]pyridine
SMILESCCCCCc1ccnc2cn[nH]c12
InChIInChI=1S/C11H15N3/c1-2-3-4-5-9-6-7-12-10-8-13-14-11(9)10/h6-8H,2-5H2,1H3,(H,13,14)
InChIKeyVWMPOKXRZVUICU-UHFFFAOYSA-N
XLogP2.69
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.26
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 7-pentyl-1H-pyrazolo[4,3-b]pyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4,5-dipentyl-1H-pyrazole
CID 66669086
4,7-di(tridecyl)-1,10-phenanthroline
CID 5194028
4,5-dihexyl-1H-pyrazole;hydrobromide
CID 174859356
4,7-didodecyl-1,10-phenanthroline
CID 10098057
4,7-dihexyl-1,10-phenanthroline
CID 10904194
4,5-dipentyl-1H-pyridazin-6-one
CID 174602267
3-ethyl-2-methyl-4-octylpyridine
CID 175330346
5-octadecoxy-4-octadecylquinoline
CID 70411958
4-tridecylquinolin-8-ol
CID 102274119
5-pentyl-1H-pyrazole
CID 13433979
4-heptyl-3-methylpyridine
CID 143666243
4-pentyl-5-prop-2-enyl-1H-pyrazole
CID 174864439

Frequently Asked Questions

What is the IUPAC name of 7-pentyl-1H-pyrazolo[4,3-b]pyridine?
The IUPAC name of 7-pentyl-1H-pyrazolo[4,3-b]pyridine (CID 68626923) is 7-pentyl-1H-pyrazolo[4,3-b]pyridine.
What is the SMILES notation for 7-pentyl-1H-pyrazolo[4,3-b]pyridine?
The canonical SMILES for 7-pentyl-1H-pyrazolo[4,3-b]pyridine is CCCCCc1ccnc2cn[nH]c12.
What is the InChIKey of 7-pentyl-1H-pyrazolo[4,3-b]pyridine?
The InChIKey is VWMPOKXRZVUICU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3/c1-2-3-4-5-9-6-7-12-10-8-13-14-11(9)10/h6-8H,2-5H2,1H3,(H,13,14).
What are the key properties of 7-pentyl-1H-pyrazolo[4,3-b]pyridine?
7-pentyl-1H-pyrazolo[4,3-b]pyridine has a molecular weight of 189.26 g/mol, XLogP of 2.69, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-pentyl-1H-pyrazolo[4,3-b]pyridine is sourced from PubChem (CID 68626923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).