3-methyl-1-(2-piperidin-4-ylethyl)indazole

C15H21N3 — CID 82513483

IUPAC3-methyl-1-(2-piperidin-4-ylethyl)indazole
SMILESCc1nn(CCC2CCNCC2)c2ccccc12
InChIInChI=1S/C15H21N3/c1-12-14-4-2-3-5-15(14)18(17-12)11-8-13-6-9-16-10-7-13/h2-5,13,16H,6-11H2,1H3
InChIKeyCADNVJGZHVQILP-UHFFFAOYSA-N
MW243.35 g/mol
LogP2.73
Rot. Bonds3

About 3-methyl-1-(2-piperidin-4-ylethyl)indazole

3-methyl-1-(2-piperidin-4-ylethyl)indazole (PubChem CID 82513483) has the molecular formula C15H21N3 and a molecular weight of 243.35 g/mol. Its IUPAC name is 3-methyl-1-(2-piperidin-4-ylethyl)indazole.

Molecular Properties

Compound Name3-methyl-1-(2-piperidin-4-ylethyl)indazole
PubChem CID82513483
Molecular FormulaC15H21N3
Molecular Weight243.35 g/mol
Exact Mass243.17
IUPAC Name3-methyl-1-(2-piperidin-4-ylethyl)indazole
SMILESCc1nn(CCC2CCNCC2)c2ccccc12
InChIInChI=1S/C15H21N3/c1-12-14-4-2-3-5-15(14)18(17-12)11-8-13-6-9-16-10-7-13/h2-5,13,16H,6-11H2,1H3
InChIKeyCADNVJGZHVQILP-UHFFFAOYSA-N
XLogP2.73
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.35
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-methyl-1-(piperidin-3-ylmethyl)indazole
CID 82512943
ethane;3-methyl-1-propylindazole
CID 144653830
3-methyl-1-(piperidin-2-ylmethyl)indazole
CID 84793021
1-methyl-3-(piperidin-4-ylmethyl)indazole
CID 84692872
4-methyl-1-(piperidin-4-ylmethyl)indazole
CID 84692855
4-methyl-1-(2-piperidin-4-ylethyl)indole
CID 61348096
3-chloro-1-[2-[4-[4-(4-methylphenyl)cyclohexyl]cyclohexyl]ethyl]indazole
CID 176717291
2-methyl-3-(3-piperidin-4-ylpropyl)quinazolin-4-one
CID 20717835
1-(1-ethylindazol-3-yl)-3-piperidin-4-ylpropan-2-one
CID 116560043
4-[2-(4-methyl-2-phenylimidazol-1-yl)ethyl]piperidine
CID 174445491
1-(piperidin-4-ylmethyl)indole
CID 18538689
1,2-dimethyl-4-(piperidin-4-ylmethyl)benzimidazole
CID 117360773

Frequently Asked Questions

What is the IUPAC name of 3-methyl-1-(2-piperidin-4-ylethyl)indazole?
The IUPAC name of 3-methyl-1-(2-piperidin-4-ylethyl)indazole (CID 82513483) is 3-methyl-1-(2-piperidin-4-ylethyl)indazole.
What is the SMILES notation for 3-methyl-1-(2-piperidin-4-ylethyl)indazole?
The canonical SMILES for 3-methyl-1-(2-piperidin-4-ylethyl)indazole is Cc1nn(CCC2CCNCC2)c2ccccc12.
What is the InChIKey of 3-methyl-1-(2-piperidin-4-ylethyl)indazole?
The InChIKey is CADNVJGZHVQILP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3/c1-12-14-4-2-3-5-15(14)18(17-12)11-8-13-6-9-16-10-7-13/h2-5,13,16H,6-11H2,1H3.
What are the key properties of 3-methyl-1-(2-piperidin-4-ylethyl)indazole?
3-methyl-1-(2-piperidin-4-ylethyl)indazole has a molecular weight of 243.35 g/mol, XLogP of 2.73, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1-(2-piperidin-4-ylethyl)indazole is sourced from PubChem (CID 82513483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).