2-piperidin-1-ylindazol-5-amine

C12H16N4 — CID 154467407

IUPAC2-piperidin-1-ylindazol-5-amine
SMILESNc1ccc2nn(N3CCCCC3)cc2c1
InChIInChI=1S/C12H16N4/c13-11-4-5-12-10(8-11)9-16(14-12)15-6-2-1-3-7-15/h4-5,8-9H,1-3,6-7,13H2
InChIKeyMFENNBALZAFRPX-UHFFFAOYSA-N
MW216.29 g/mol
LogP1.74
Rot. Bonds1

About 2-piperidin-1-ylindazol-5-amine

2-piperidin-1-ylindazol-5-amine (PubChem CID 154467407) has the molecular formula C12H16N4 and a molecular weight of 216.29 g/mol. Its IUPAC name is 2-piperidin-1-ylindazol-5-amine.

Molecular Properties

Compound Name2-piperidin-1-ylindazol-5-amine
PubChem CID154467407
Molecular FormulaC12H16N4
Molecular Weight216.29 g/mol
Exact Mass216.14
IUPAC Name2-piperidin-1-ylindazol-5-amine
SMILESNc1ccc2nn(N3CCCCC3)cc2c1
InChIInChI=1S/C12H16N4/c13-11-4-5-12-10(8-11)9-16(14-12)15-6-2-1-3-7-15/h4-5,8-9H,1-3,6-7,13H2
InChIKeyMFENNBALZAFRPX-UHFFFAOYSA-N
XLogP1.74
TPSA47.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.29
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

1H-Indazol-5-amine
CID 88012
1H-Indazole
CID 9221
1-benzyl-1H-indazole
CID 797066
4-Methyl-1H-indazole
CID 820806
5-(2-phenethylpiperazin-1-yl)-1H-indazole
CID 49798218
1-Methyl-1H-indazole
CID 139456
1-methyl-1H-indazol-5-amine
CID 2768032
6-Methyl-1H-indazole
CID 12639191
N-(1-benzylpiperidin-4-yl)-1H-indazol-5-amine
CID 9836178
N-(1-benzylpiperidin-3-yl)-1H-indazol-5-amine
CID 9857714
N-(1-(4-fluorobenzyl)piperidin-3-yl)-1H-indazol-5-amine
CID 9858433
N-(1H-5-Indazolyl)-N-(4-piperidyl)amine
CID 9899273

Frequently Asked Questions

What is the IUPAC name of 2-piperidin-1-ylindazol-5-amine?
The IUPAC name of 2-piperidin-1-ylindazol-5-amine (CID 154467407) is 2-piperidin-1-ylindazol-5-amine.
What is the SMILES notation for 2-piperidin-1-ylindazol-5-amine?
The canonical SMILES for 2-piperidin-1-ylindazol-5-amine is Nc1ccc2nn(N3CCCCC3)cc2c1.
What is the InChIKey of 2-piperidin-1-ylindazol-5-amine?
The InChIKey is MFENNBALZAFRPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N4/c13-11-4-5-12-10(8-11)9-16(14-12)15-6-2-1-3-7-15/h4-5,8-9H,1-3,6-7,13H2.
What are the key properties of 2-piperidin-1-ylindazol-5-amine?
2-piperidin-1-ylindazol-5-amine has a molecular weight of 216.29 g/mol, XLogP of 1.74, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-piperidin-1-ylindazol-5-amine is sourced from PubChem (CID 154467407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).