imidazo[1,5-a]quinoline-3-carboxamide;dihydrochloride

C12H11Cl2N3O — CID 141139843

IUPACimidazo[1,5-a]quinoline-3-carboxamide;dihydrochloride
SMILESCl.Cl.NC(=O)c1ncn2c1ccc1ccccc12
InChIInChI=1S/C12H9N3O.2ClH/c13-12(16)11-10-6-5-8-3-1-2-4-9(8)15(10)7-14-11;;/h1-7H,(H2,13,16);2*1H
InChIKeyVFIVKSSAYDKVDI-UHFFFAOYSA-N
MW284.15 g/mol
LogP2.43
Rot. Bonds1

About imidazo[1,5-a]quinoline-3-carboxamide;dihydrochloride

imidazo[1,5-a]quinoline-3-carboxamide;dihydrochloride (PubChem CID 141139843) has the molecular formula C12H11Cl2N3O and a molecular weight of 284.15 g/mol. Its IUPAC name is imidazo[1,5-a]quinoline-3-carboxamide;dihydrochloride.

Molecular Properties

Compound Nameimidazo[1,5-a]quinoline-3-carboxamide;dihydrochloride
PubChem CID141139843
Molecular FormulaC12H11Cl2N3O
Molecular Weight284.15 g/mol
Exact Mass283.03
IUPAC Nameimidazo[1,5-a]quinoline-3-carboxamide;dihydrochloride
SMILESCl.Cl.NC(=O)c1ncn2c1ccc1ccccc12
InChIInChI=1S/C12H9N3O.2ClH/c13-12(16)11-10-6-5-8-3-1-2-4-9(8)15(10)7-14-11;;/h1-7H,(H2,13,16);2*1H
InChIKeyVFIVKSSAYDKVDI-UHFFFAOYSA-N
XLogP2.43
TPSA60.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.15
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of imidazo[1,5-a]quinoline-3-carboxamide;dihydrochloride?
The IUPAC name of imidazo[1,5-a]quinoline-3-carboxamide;dihydrochloride (CID 141139843) is imidazo[1,5-a]quinoline-3-carboxamide;dihydrochloride.
What is the SMILES notation for imidazo[1,5-a]quinoline-3-carboxamide;dihydrochloride?
The canonical SMILES for imidazo[1,5-a]quinoline-3-carboxamide;dihydrochloride is Cl.Cl.NC(=O)c1ncn2c1ccc1ccccc12.
What is the InChIKey of imidazo[1,5-a]quinoline-3-carboxamide;dihydrochloride?
The InChIKey is VFIVKSSAYDKVDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9N3O.2ClH/c13-12(16)11-10-6-5-8-3-1-2-4-9(8)15(10)7-14-11;;/h1-7H,(H2,13,16);2*1H.
What are the key properties of imidazo[1,5-a]quinoline-3-carboxamide;dihydrochloride?
imidazo[1,5-a]quinoline-3-carboxamide;dihydrochloride has a molecular weight of 284.15 g/mol, XLogP of 2.43, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for imidazo[1,5-a]quinoline-3-carboxamide;dihydrochloride is sourced from PubChem (CID 141139843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).