quinolin-2-amine;zirconium

C9H8N2Zr — CID 175251209

IUPACquinolin-2-amine;zirconium
SMILESNc1ccc2ccccc2n1.[Zr]
InChIInChI=1S/C9H8N2.Zr/c10-9-6-5-7-3-1-2-4-8(7)11-9;/h1-6H,(H2,10,11);
InChIKeyMRXJSJNHTGLKSB-UHFFFAOYSA-N
MW235.40 g/mol
LogP1.81
Rot. Bonds

About quinolin-2-amine;zirconium

quinolin-2-amine;zirconium (PubChem CID 175251209) has the molecular formula C9H8N2Zr and a molecular weight of 235.40 g/mol. Its IUPAC name is quinolin-2-amine;zirconium.

Molecular Properties

Compound Namequinolin-2-amine;zirconium
PubChem CID175251209
Molecular FormulaC9H8N2Zr
Molecular Weight235.40 g/mol
Exact Mass233.97
IUPAC Namequinolin-2-amine;zirconium
SMILESNc1ccc2ccccc2n1.[Zr]
InChIInChI=1S/C9H8N2.Zr/c10-9-6-5-7-3-1-2-4-8(7)11-9;/h1-6H,(H2,10,11);
InChIKeyMRXJSJNHTGLKSB-UHFFFAOYSA-N
XLogP1.81
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.40
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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quinolin-2-amine;sulfuric acid
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2-fluoroquinoline;methane
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quinoline-2,6-diamine
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quinoline-2-carboxamide;hydrobromide
CID 141009871
quinolin-2-ylmethanamine;dihydrochloride
CID 18507294
2-iodoquinoline
CID 159061150
5-methyl-1,3-benzodioxole;pyrimidin-2-amine;quinolin-2-amine
CID 161368124
4-quinolin-2-ylpyridin-2-amine
CID 82556017
acridine;acridine-3,6-diamine
CID 21276006
silver quinolin-2-olate
CID 162166701

Frequently Asked Questions

What is the IUPAC name of quinolin-2-amine;zirconium?
The IUPAC name of quinolin-2-amine;zirconium (CID 175251209) is quinolin-2-amine;zirconium.
What is the SMILES notation for quinolin-2-amine;zirconium?
The canonical SMILES for quinolin-2-amine;zirconium is Nc1ccc2ccccc2n1.[Zr].
What is the InChIKey of quinolin-2-amine;zirconium?
The InChIKey is MRXJSJNHTGLKSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8N2.Zr/c10-9-6-5-7-3-1-2-4-8(7)11-9;/h1-6H,(H2,10,11);.
What are the key properties of quinolin-2-amine;zirconium?
quinolin-2-amine;zirconium has a molecular weight of 235.40 g/mol, XLogP of 1.81, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for quinolin-2-amine;zirconium is sourced from PubChem (CID 175251209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).