5-(1-propylpiperidin-3-yl)oxy-1H-indazole

C15H21N3O — CID 18447202

IUPAC5-(1-propylpiperidin-3-yl)oxy-1H-indazole
SMILESCCCN1CCCC(Oc2ccc3[nH]ncc3c2)C1
InChIInChI=1S/C15H21N3O/c1-2-7-18-8-3-4-14(11-18)19-13-5-6-15-12(9-13)10-16-17-15/h5-6,9-10,14H,2-4,7-8,11H2,1H3,(H,16,17)
InChIKeyKAKMXSOTNBYIAU-UHFFFAOYSA-N
MW259.35 g/mol
LogP2.82
Rot. Bonds4

About 5-(1-propylpiperidin-3-yl)oxy-1H-indazole

5-(1-propylpiperidin-3-yl)oxy-1H-indazole (PubChem CID 18447202) has the molecular formula C15H21N3O and a molecular weight of 259.35 g/mol. Its IUPAC name is 5-(1-propylpiperidin-3-yl)oxy-1H-indazole.

Molecular Properties

Compound Name5-(1-propylpiperidin-3-yl)oxy-1H-indazole
PubChem CID18447202
Molecular FormulaC15H21N3O
Molecular Weight259.35 g/mol
Exact Mass259.17
IUPAC Name5-(1-propylpiperidin-3-yl)oxy-1H-indazole
SMILESCCCN1CCCC(Oc2ccc3[nH]ncc3c2)C1
InChIInChI=1S/C15H21N3O/c1-2-7-18-8-3-4-14(11-18)19-13-5-6-15-12(9-13)10-16-17-15/h5-6,9-10,14H,2-4,7-8,11H2,1H3,(H,16,17)
InChIKeyKAKMXSOTNBYIAU-UHFFFAOYSA-N
XLogP2.82
TPSA41.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.35
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(1-propylpiperidin-3-yl)oxy-1H-indazole?
The IUPAC name of 5-(1-propylpiperidin-3-yl)oxy-1H-indazole (CID 18447202) is 5-(1-propylpiperidin-3-yl)oxy-1H-indazole.
What is the SMILES notation for 5-(1-propylpiperidin-3-yl)oxy-1H-indazole?
The canonical SMILES for 5-(1-propylpiperidin-3-yl)oxy-1H-indazole is CCCN1CCCC(Oc2ccc3[nH]ncc3c2)C1.
What is the InChIKey of 5-(1-propylpiperidin-3-yl)oxy-1H-indazole?
The InChIKey is KAKMXSOTNBYIAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O/c1-2-7-18-8-3-4-14(11-18)19-13-5-6-15-12(9-13)10-16-17-15/h5-6,9-10,14H,2-4,7-8,11H2,1H3,(H,16,17).
What are the key properties of 5-(1-propylpiperidin-3-yl)oxy-1H-indazole?
5-(1-propylpiperidin-3-yl)oxy-1H-indazole has a molecular weight of 259.35 g/mol, XLogP of 2.82, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1-propylpiperidin-3-yl)oxy-1H-indazole is sourced from PubChem (CID 18447202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).