6-(2-amino-4-pyridinyl)-1H-indazol-3-amine;hydrochloride

C12H12ClN5 — CID 53319792

IUPAC6-(2-amino-4-pyridinyl)-1H-indazol-3-amine;hydrochloride
SMILESCl.Nc1cc(-c2ccc3c(N)n[nH]c3c2)ccn1
InChIInChI=1S/C12H11N5.ClH/c13-11-6-8(3-4-15-11)7-1-2-9-10(5-7)16-17-12(9)14;/h1-6H,(H2,13,15)(H3,14,16,17);1H
InChIKeyYWQYZPYKXXRYTJ-UHFFFAOYSA-N
MW261.72 g/mol
LogP2.21
Rot. Bonds1

About 6-(2-amino-4-pyridinyl)-1H-indazol-3-amine;hydrochloride

6-(2-amino-4-pyridinyl)-1H-indazol-3-amine;hydrochloride (PubChem CID 53319792) has the molecular formula C12H12ClN5 and a molecular weight of 261.72 g/mol. Its IUPAC name is 6-(2-amino-4-pyridinyl)-1H-indazol-3-amine;hydrochloride.

Molecular Properties

Compound Name6-(2-amino-4-pyridinyl)-1H-indazol-3-amine;hydrochloride
PubChem CID53319792
Molecular FormulaC12H12ClN5
Molecular Weight261.72 g/mol
Exact Mass261.08
IUPAC Name6-(2-amino-4-pyridinyl)-1H-indazol-3-amine;hydrochloride
SMILESCl.Nc1cc(-c2ccc3c(N)n[nH]c3c2)ccn1
InChIInChI=1S/C12H11N5.ClH/c13-11-6-8(3-4-15-11)7-1-2-9-10(5-7)16-17-12(9)14;/h1-6H,(H2,13,15)(H3,14,16,17);1H
InChIKeyYWQYZPYKXXRYTJ-UHFFFAOYSA-N
XLogP2.21
TPSA93.61 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.72
LogP ≤ 52.21
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(2-amino-4-pyridinyl)-1H-indazol-3-amine;hydrochloride?
The IUPAC name of 6-(2-amino-4-pyridinyl)-1H-indazol-3-amine;hydrochloride (CID 53319792) is 6-(2-amino-4-pyridinyl)-1H-indazol-3-amine;hydrochloride.
What is the SMILES notation for 6-(2-amino-4-pyridinyl)-1H-indazol-3-amine;hydrochloride?
The canonical SMILES for 6-(2-amino-4-pyridinyl)-1H-indazol-3-amine;hydrochloride is Cl.Nc1cc(-c2ccc3c(N)n[nH]c3c2)ccn1.
What is the InChIKey of 6-(2-amino-4-pyridinyl)-1H-indazol-3-amine;hydrochloride?
The InChIKey is YWQYZPYKXXRYTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11N5.ClH/c13-11-6-8(3-4-15-11)7-1-2-9-10(5-7)16-17-12(9)14;/h1-6H,(H2,13,15)(H3,14,16,17);1H.
What are the key properties of 6-(2-amino-4-pyridinyl)-1H-indazol-3-amine;hydrochloride?
6-(2-amino-4-pyridinyl)-1H-indazol-3-amine;hydrochloride has a molecular weight of 261.72 g/mol, XLogP of 2.21, 1 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-amino-4-pyridinyl)-1H-indazol-3-amine;hydrochloride is sourced from PubChem (CID 53319792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).