chlorogold;N,N-dimethyl-2-(2,4,6-trimethylphenyl)-1H-imidazo[1,5-a]quinolin-1-id-9-amine

C22H24AuClN3- — CID 172516514

IUPACchlorogold;N,N-dimethyl-2-(2,4,6-trimethylphenyl)-1H-imidazo[1,5-a]quinolin-1-id-9-amine
SMILESCc1cc(C)c(N2C=C3C=Cc4cccc(N(C)C)c4N3[CH-]2)c(C)c1.Cl[Au]
InChIInChI=1S/C22H24N3.Au.ClH/c1-15-11-16(2)21(17(3)12-15)24-13-19-10-9-18-7-6-8-20(23(4)5)22(18)25(19)14-24;;/h6-14H,1-5H3;;1H/q-1;+1;/p-1
InChIKeyFFRZMABRURGDKR-UHFFFAOYSA-M
MW562.88 g/mol
LogP5.68
Rot. Bonds2

About chlorogold;N,N-dimethyl-2-(2,4,6-trimethylphenyl)-1H-imidazo[1,5-a]quinolin-1-id-9-amine

chlorogold;N,N-dimethyl-2-(2,4,6-trimethylphenyl)-1H-imidazo[1,5-a]quinolin-1-id-9-amine (PubChem CID 172516514) has the molecular formula C22H24AuClN3- and a molecular weight of 562.88 g/mol. Its IUPAC name is chlorogold;N,N-dimethyl-2-(2,4,6-trimethylphenyl)-1H-imidazo[1,5-a]quinolin-1-id-9-amine.

Molecular Properties

Compound Namechlorogold;N,N-dimethyl-2-(2,4,6-trimethylphenyl)-1H-imidazo[1,5-a]quinolin-1-id-9-amine
PubChem CID172516514
Molecular FormulaC22H24AuClN3-
Molecular Weight562.88 g/mol
Exact Mass562.13
IUPAC Namechlorogold;N,N-dimethyl-2-(2,4,6-trimethylphenyl)-1H-imidazo[1,5-a]quinolin-1-id-9-amine
SMILESCc1cc(C)c(N2C=C3C=Cc4cccc(N(C)C)c4N3[CH-]2)c(C)c1.Cl[Au]
InChIInChI=1S/C22H24N3.Au.ClH/c1-15-11-16(2)21(17(3)12-15)24-13-19-10-9-18-7-6-8-20(23(4)5)22(18)25(19)14-24;;/h6-14H,1-5H3;;1H/q-1;+1;/p-1
InChIKeyFFRZMABRURGDKR-UHFFFAOYSA-M
XLogP5.68
TPSA9.72 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500562.88
LogP ≤ 55.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

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CID 135084953
1,3-bis(2,4,6-trimethylphenyl)-2H-imidazol-2-ide;trichloroindigane
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1,3-bis(2,4,6-trimethylphenyl)-2H-imidazol-2-ide;carbanide;chloronickel
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2-(2,6-dibenzhydryl-4-methylphenyl)-5-(2,4,6-trimethylphenyl)-3H-imidazo[1,5-a]pyridin-3-ide;gold(1+);chloride
CID 174057934
bis(1,3-bis(2,4,6-trimethylphenyl)-2H-imidazol-2-ide);bis(naphthalene-1,4-dione);bis(palladium)
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5,6-dimethyl-1-(2,4,6-trimethylphenyl)-3-[3-[3-(2,4,6-trimethylphenyl)-2H-imidazol-2-id-1-yl]benzene-2-id-1-yl]-2H-benzimidazol-2-ide;platinum(4+);cyanide
CID 164730504
acenaphthylene;1,3,5-trimethylbenzene
CID 175249677
5-(dimethylamino)-N-(2-hydroxy-3,5-dimethylphenyl)naphthalene-1-sulfonamide
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Frequently Asked Questions

What is the IUPAC name of chlorogold;N,N-dimethyl-2-(2,4,6-trimethylphenyl)-1H-imidazo[1,5-a]quinolin-1-id-9-amine?
The IUPAC name of chlorogold;N,N-dimethyl-2-(2,4,6-trimethylphenyl)-1H-imidazo[1,5-a]quinolin-1-id-9-amine (CID 172516514) is chlorogold;N,N-dimethyl-2-(2,4,6-trimethylphenyl)-1H-imidazo[1,5-a]quinolin-1-id-9-amine.
What is the SMILES notation for chlorogold;N,N-dimethyl-2-(2,4,6-trimethylphenyl)-1H-imidazo[1,5-a]quinolin-1-id-9-amine?
The canonical SMILES for chlorogold;N,N-dimethyl-2-(2,4,6-trimethylphenyl)-1H-imidazo[1,5-a]quinolin-1-id-9-amine is Cc1cc(C)c(N2C=C3C=Cc4cccc(N(C)C)c4N3[CH-]2)c(C)c1.Cl[Au].
What is the InChIKey of chlorogold;N,N-dimethyl-2-(2,4,6-trimethylphenyl)-1H-imidazo[1,5-a]quinolin-1-id-9-amine?
The InChIKey is FFRZMABRURGDKR-UHFFFAOYSA-M. The full InChI is InChI=1S/C22H24N3.Au.ClH/c1-15-11-16(2)21(17(3)12-15)24-13-19-10-9-18-7-6-8-20(23(4)5)22(18)25(19)14-24;;/h6-14H,1-5H3;;1H/q-1;+1;/p-1.
What are the key properties of chlorogold;N,N-dimethyl-2-(2,4,6-trimethylphenyl)-1H-imidazo[1,5-a]quinolin-1-id-9-amine?
chlorogold;N,N-dimethyl-2-(2,4,6-trimethylphenyl)-1H-imidazo[1,5-a]quinolin-1-id-9-amine has a molecular weight of 562.88 g/mol, XLogP of 5.68, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for chlorogold;N,N-dimethyl-2-(2,4,6-trimethylphenyl)-1H-imidazo[1,5-a]quinolin-1-id-9-amine is sourced from PubChem (CID 172516514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).