3-piperidin-4-yl-5-propan-2-yl-2H-indazole

C15H21N3 — CID 18365248

IUPAC3-piperidin-4-yl-5-propan-2-yl-2H-indazole
SMILESCC(C)c1ccc2n[nH]c(C3CCNCC3)c2c1
InChIInChI=1S/C15H21N3/c1-10(2)12-3-4-14-13(9-12)15(18-17-14)11-5-7-16-8-6-11/h3-4,9-11,16H,5-8H2,1-2H3,(H,17,18)
InChIKeyRCQWMXYMJVBGQL-UHFFFAOYSA-N
MW243.35 g/mol
LogP3.15
Rot. Bonds2

About 3-piperidin-4-yl-5-propan-2-yl-2H-indazole

3-piperidin-4-yl-5-propan-2-yl-2H-indazole (PubChem CID 18365248) has the molecular formula C15H21N3 and a molecular weight of 243.35 g/mol. Its IUPAC name is 3-piperidin-4-yl-5-propan-2-yl-2H-indazole.

Molecular Properties

Compound Name3-piperidin-4-yl-5-propan-2-yl-2H-indazole
PubChem CID18365248
Molecular FormulaC15H21N3
Molecular Weight243.35 g/mol
Exact Mass243.17
IUPAC Name3-piperidin-4-yl-5-propan-2-yl-2H-indazole
SMILESCC(C)c1ccc2n[nH]c(C3CCNCC3)c2c1
InChIInChI=1S/C15H21N3/c1-10(2)12-3-4-14-13(9-12)15(18-17-14)11-5-7-16-8-6-11/h3-4,9-11,16H,5-8H2,1-2H3,(H,17,18)
InChIKeyRCQWMXYMJVBGQL-UHFFFAOYSA-N
XLogP3.15
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.35
LogP ≤ 53.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-piperidin-4-yl-5-propan-2-yl-2H-indazole?
The IUPAC name of 3-piperidin-4-yl-5-propan-2-yl-2H-indazole (CID 18365248) is 3-piperidin-4-yl-5-propan-2-yl-2H-indazole.
What is the SMILES notation for 3-piperidin-4-yl-5-propan-2-yl-2H-indazole?
The canonical SMILES for 3-piperidin-4-yl-5-propan-2-yl-2H-indazole is CC(C)c1ccc2n[nH]c(C3CCNCC3)c2c1.
What is the InChIKey of 3-piperidin-4-yl-5-propan-2-yl-2H-indazole?
The InChIKey is RCQWMXYMJVBGQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3/c1-10(2)12-3-4-14-13(9-12)15(18-17-14)11-5-7-16-8-6-11/h3-4,9-11,16H,5-8H2,1-2H3,(H,17,18).
What are the key properties of 3-piperidin-4-yl-5-propan-2-yl-2H-indazole?
3-piperidin-4-yl-5-propan-2-yl-2H-indazole has a molecular weight of 243.35 g/mol, XLogP of 3.15, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-piperidin-4-yl-5-propan-2-yl-2H-indazole is sourced from PubChem (CID 18365248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).