4-methyl-1-(piperidin-4-ylmethyl)indazole

C14H19N3 — CID 84692855

IUPAC4-methyl-1-(piperidin-4-ylmethyl)indazole
SMILESCc1cccc2c1cnn2CC1CCNCC1
InChIInChI=1S/C14H19N3/c1-11-3-2-4-14-13(11)9-16-17(14)10-12-5-7-15-8-6-12/h2-4,9,12,15H,5-8,10H2,1H3
InChIKeyATKKUAJTSKYYQN-UHFFFAOYSA-N
MW229.33 g/mol
LogP2.34
Rot. Bonds2

About 4-methyl-1-(piperidin-4-ylmethyl)indazole

4-methyl-1-(piperidin-4-ylmethyl)indazole (PubChem CID 84692855) has the molecular formula C14H19N3 and a molecular weight of 229.33 g/mol. Its IUPAC name is 4-methyl-1-(piperidin-4-ylmethyl)indazole.

Molecular Properties

Compound Name4-methyl-1-(piperidin-4-ylmethyl)indazole
PubChem CID84692855
Molecular FormulaC14H19N3
Molecular Weight229.33 g/mol
Exact Mass229.16
IUPAC Name4-methyl-1-(piperidin-4-ylmethyl)indazole
SMILESCc1cccc2c1cnn2CC1CCNCC1
InChIInChI=1S/C14H19N3/c1-11-3-2-4-14-13(11)9-16-17(14)10-12-5-7-15-8-6-12/h2-4,9,12,15H,5-8,10H2,1H3
InChIKeyATKKUAJTSKYYQN-UHFFFAOYSA-N
XLogP2.34
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.33
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-methyl-1-(2-piperidin-4-ylethyl)indazole
CID 82513483
4-methyl-1-(2-piperidin-4-ylethyl)indole
CID 61348096
7-(2-methoxyethoxy)-N-[1-(piperidin-4-ylmethyl)indazol-4-yl]imidazo[1,2-a]pyridine-3-carboxamide
CID 67976330
4-[(2,6-dimethylphenyl)methyl]piperidine
CID 103840873
1,2-dimethyl-4-(piperidin-4-ylmethyl)benzimidazole
CID 117360773
6-methyl-2-(piperidin-4-ylmethyl)pyridazin-3-one
CID 62922665
(4-methylindazol-1-yl)phosphane
CID 134575282
1-(cyclopropylmethyl)-4-fluoro-5-propan-2-ylindazole
CID 176644933
1-(cyclopropylmethyl)-6-methylindazol-4-amine
CID 68618345
6-fluoro-3-[5-methyl-1-(piperidin-4-ylmethyl)pyrazol-4-yl]-1H-indole
CID 118060606
1,4-dimethyl-7-(piperidin-4-ylmethyl)pyrazolo[5,4-b]pyridin-6-one
CID 82105316
4-[5-(4-methylphenyl)-1-(piperidin-4-ylmethyl)pyrazolo[4,5-b]pyridin-6-yl]benzonitrile
CID 121283073

Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-(piperidin-4-ylmethyl)indazole?
The IUPAC name of 4-methyl-1-(piperidin-4-ylmethyl)indazole (CID 84692855) is 4-methyl-1-(piperidin-4-ylmethyl)indazole.
What is the SMILES notation for 4-methyl-1-(piperidin-4-ylmethyl)indazole?
The canonical SMILES for 4-methyl-1-(piperidin-4-ylmethyl)indazole is Cc1cccc2c1cnn2CC1CCNCC1.
What is the InChIKey of 4-methyl-1-(piperidin-4-ylmethyl)indazole?
The InChIKey is ATKKUAJTSKYYQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3/c1-11-3-2-4-14-13(11)9-16-17(14)10-12-5-7-15-8-6-12/h2-4,9,12,15H,5-8,10H2,1H3.
What are the key properties of 4-methyl-1-(piperidin-4-ylmethyl)indazole?
4-methyl-1-(piperidin-4-ylmethyl)indazole has a molecular weight of 229.33 g/mol, XLogP of 2.34, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-(piperidin-4-ylmethyl)indazole is sourced from PubChem (CID 84692855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).