5-methoxy-1-methyl-3-piperidin-2-ylindazole

C14H19N3O — CID 82622650

IUPAC5-methoxy-1-methyl-3-piperidin-2-ylindazole
SMILESCOc1ccc2c(c1)c(C1CCCCN1)nn2C
InChIInChI=1S/C14H19N3O/c1-17-13-7-6-10(18-2)9-11(13)14(16-17)12-5-3-4-8-15-12/h6-7,9,12,15H,3-5,8H2,1-2H3
InChIKeyQLWQCKYPLFMMQY-UHFFFAOYSA-N
MW245.33 g/mol
LogP2.40
Rot. Bonds2

About 5-methoxy-1-methyl-3-piperidin-2-ylindazole

5-methoxy-1-methyl-3-piperidin-2-ylindazole (PubChem CID 82622650) has the molecular formula C14H19N3O and a molecular weight of 245.33 g/mol. Its IUPAC name is 5-methoxy-1-methyl-3-piperidin-2-ylindazole.

Molecular Properties

Compound Name5-methoxy-1-methyl-3-piperidin-2-ylindazole
PubChem CID82622650
Molecular FormulaC14H19N3O
Molecular Weight245.33 g/mol
Exact Mass245.15
IUPAC Name5-methoxy-1-methyl-3-piperidin-2-ylindazole
SMILESCOc1ccc2c(c1)c(C1CCCCN1)nn2C
InChIInChI=1S/C14H19N3O/c1-17-13-7-6-10(18-2)9-11(13)14(16-17)12-5-3-4-8-15-12/h6-7,9,12,15H,3-5,8H2,1-2H3
InChIKeyQLWQCKYPLFMMQY-UHFFFAOYSA-N
XLogP2.40
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.33
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-methoxy-1-methyl-3-piperidin-2-ylindazole 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

2-[3-(4-methoxy-2-methylphenyl)imidazol-4-yl]piperidine
CID 114705681
(2R)-2-(6-methoxynaphthalen-2-yl)piperidine
CID 171195323
(2S)-2-(2,4-dimethoxyphenyl)piperidine
CID 7022848
2-(2-bromo-4-methoxyphenyl)piperidine
CID 82625568
4-methoxy-2-[(2S)-piperidin-2-yl]phenol
CID 131531573
(2R)-2-(2,4-dimethoxyphenyl)piperidine;hydrochloride
CID 171195361
4-methoxy-2-[(2R)-piperidin-2-yl]phenol
CID 131513044
(2S)-2-(6-methoxynaphthalen-2-yl)piperidine;hydrochloride
CID 171194817
(2S)-2-(4-methoxy-2-methylphenyl)azepane
CID 26189003
(2S)-2-(2-fluoro-4-methoxyphenyl)piperidine;hydrochloride
CID 171194833
2-(2-bromo-5-methoxyphenyl)azepane
CID 62543075
(2R)-2-(2-iodo-5-methoxyphenyl)pyrrolidine
CID 130676134

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-1-methyl-3-piperidin-2-ylindazole?
The IUPAC name of 5-methoxy-1-methyl-3-piperidin-2-ylindazole (CID 82622650) is 5-methoxy-1-methyl-3-piperidin-2-ylindazole.
What is the SMILES notation for 5-methoxy-1-methyl-3-piperidin-2-ylindazole?
The canonical SMILES for 5-methoxy-1-methyl-3-piperidin-2-ylindazole is COc1ccc2c(c1)c(C1CCCCN1)nn2C.
What is the InChIKey of 5-methoxy-1-methyl-3-piperidin-2-ylindazole?
The InChIKey is QLWQCKYPLFMMQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O/c1-17-13-7-6-10(18-2)9-11(13)14(16-17)12-5-3-4-8-15-12/h6-7,9,12,15H,3-5,8H2,1-2H3.
What are the key properties of 5-methoxy-1-methyl-3-piperidin-2-ylindazole?
5-methoxy-1-methyl-3-piperidin-2-ylindazole has a molecular weight of 245.33 g/mol, XLogP of 2.40, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-1-methyl-3-piperidin-2-ylindazole is sourced from PubChem (CID 82622650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).