1-methyl-N-pyridin-4-ylindazol-6-amine

C13H12N4 — CID 82536160

IUPAC1-methyl-N-pyridin-4-ylindazol-6-amine
SMILESCn1ncc2ccc(Nc3ccncc3)cc21
InChIInChI=1S/C13H12N4/c1-17-13-8-12(3-2-10(13)9-15-17)16-11-4-6-14-7-5-11/h2-9H,1H3,(H,14,16)
InChIKeyYTTVMZOPIGGALM-UHFFFAOYSA-N
MW224.27 g/mol
LogP2.71
Rot. Bonds2

About 1-methyl-N-pyridin-4-ylindazol-6-amine

1-methyl-N-pyridin-4-ylindazol-6-amine (PubChem CID 82536160) has the molecular formula C13H12N4 and a molecular weight of 224.27 g/mol. Its IUPAC name is 1-methyl-N-pyridin-4-ylindazol-6-amine.

Molecular Properties

Compound Name1-methyl-N-pyridin-4-ylindazol-6-amine
PubChem CID82536160
Molecular FormulaC13H12N4
Molecular Weight224.27 g/mol
Exact Mass224.11
IUPAC Name1-methyl-N-pyridin-4-ylindazol-6-amine
SMILESCn1ncc2ccc(Nc3ccncc3)cc21
InChIInChI=1S/C13H12N4/c1-17-13-8-12(3-2-10(13)9-15-17)16-11-4-6-14-7-5-11/h2-9H,1H3,(H,14,16)
InChIKeyYTTVMZOPIGGALM-UHFFFAOYSA-N
XLogP2.71
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.27
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-pyridin-4-ylindazol-6-amine?
The IUPAC name of 1-methyl-N-pyridin-4-ylindazol-6-amine (CID 82536160) is 1-methyl-N-pyridin-4-ylindazol-6-amine.
What is the SMILES notation for 1-methyl-N-pyridin-4-ylindazol-6-amine?
The canonical SMILES for 1-methyl-N-pyridin-4-ylindazol-6-amine is Cn1ncc2ccc(Nc3ccncc3)cc21.
What is the InChIKey of 1-methyl-N-pyridin-4-ylindazol-6-amine?
The InChIKey is YTTVMZOPIGGALM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12N4/c1-17-13-8-12(3-2-10(13)9-15-17)16-11-4-6-14-7-5-11/h2-9H,1H3,(H,14,16).
What are the key properties of 1-methyl-N-pyridin-4-ylindazol-6-amine?
1-methyl-N-pyridin-4-ylindazol-6-amine has a molecular weight of 224.27 g/mol, XLogP of 2.71, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-pyridin-4-ylindazol-6-amine is sourced from PubChem (CID 82536160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).