N,N-dimethyl-2-phenyl-6-phenylbenzene-5-id-1-amine;yttrium

C20H17NY-2 — CID 171607350

IUPACN,N-dimethyl-2-phenyl-6-phenylbenzene-5-id-1-amine;yttrium
SMILESCN(C)c1c(-c2[c-]cccc2)[c-]ccc1-c1ccccc1.[Y]
InChIInChI=1S/C20H17N.Y/c1-21(2)20-18(16-10-5-3-6-11-16)14-9-15-19(20)17-12-7-4-8-13-17;/h3-12,14H,1-2H3;/q-2;
InChIKeyXSJZNPYFFKPCEI-UHFFFAOYSA-N
MW360.27 g/mol
LogP4.68
Rot. Bonds3

About N,N-dimethyl-2-phenyl-6-phenylbenzene-5-id-1-amine;yttrium

N,N-dimethyl-2-phenyl-6-phenylbenzene-5-id-1-amine;yttrium (PubChem CID 171607350) has the molecular formula C20H17NY-2 and a molecular weight of 360.27 g/mol. Its IUPAC name is N,N-dimethyl-2-phenyl-6-phenylbenzene-5-id-1-amine;yttrium.

Molecular Properties

Compound NameN,N-dimethyl-2-phenyl-6-phenylbenzene-5-id-1-amine;yttrium
PubChem CID171607350
Molecular FormulaC20H17NY-2
Molecular Weight360.27 g/mol
Exact Mass360.04
IUPAC NameN,N-dimethyl-2-phenyl-6-phenylbenzene-5-id-1-amine;yttrium
SMILESCN(C)c1c(-c2[c-]cccc2)[c-]ccc1-c1ccccc1.[Y]
InChIInChI=1S/C20H17N.Y/c1-21(2)20-18(16-10-5-3-6-11-16)14-9-15-19(20)17-12-7-4-8-13-17;/h3-12,14H,1-2H3;/q-2;
InChIKeyXSJZNPYFFKPCEI-UHFFFAOYSA-N
XLogP4.68
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.27
LogP ≤ 54.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze N,N-dimethyl-2-phenyl-6-phenylbenzene-5-id-1-amine;yttrium with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

ethane;phenylbenzene;yttrium
CID 161119758
1-methyl-2-(2-methylphenyl)-3-phenyl-4H-pyridin-1-ium-4-ide;yttrium
CID 172528303
iridium;2-methyl-3-phenyl-6-phenylpyridine
CID 58435059
2,5-di(phenyl)-1,6-dihydronaphthalene-1,6-diide;ethane;tris(yttrium)
CID 162057595
iridium;phenylbenzene
CID 58599975
palladium(2+);phenylbenzene
CID 58471959
chlororuthenium(2+);phenylbenzene;tris(trimethylphosphanium)
CID 58599965
1,1'-biphenyl;palladium;2-phenylaniline
CID 174222698
9-methyl-4-phenyl-3H-carbazol-3-ide;yttrium
CID 153420914
iridium;4-phenyl-1-phenylisoquinoline
CID 58240172
zinc;ethynyl(trimethyl)silane;phenylbenzene
CID 177389765
1-phenyl-4-[4-[4-(4-phenylbenzene-3,6-diid-1-yl)benzene-3,6-diid-1-yl]benzene-3,6-diid-1-yl]benzene-3,6-diide;pentakis(yttrium)
CID 153293138

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-phenyl-6-phenylbenzene-5-id-1-amine;yttrium?
The IUPAC name of N,N-dimethyl-2-phenyl-6-phenylbenzene-5-id-1-amine;yttrium (CID 171607350) is N,N-dimethyl-2-phenyl-6-phenylbenzene-5-id-1-amine;yttrium.
What is the SMILES notation for N,N-dimethyl-2-phenyl-6-phenylbenzene-5-id-1-amine;yttrium?
The canonical SMILES for N,N-dimethyl-2-phenyl-6-phenylbenzene-5-id-1-amine;yttrium is CN(C)c1c(-c2[c-]cccc2)[c-]ccc1-c1ccccc1.[Y].
What is the InChIKey of N,N-dimethyl-2-phenyl-6-phenylbenzene-5-id-1-amine;yttrium?
The InChIKey is XSJZNPYFFKPCEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17N.Y/c1-21(2)20-18(16-10-5-3-6-11-16)14-9-15-19(20)17-12-7-4-8-13-17;/h3-12,14H,1-2H3;/q-2;.
What are the key properties of N,N-dimethyl-2-phenyl-6-phenylbenzene-5-id-1-amine;yttrium?
N,N-dimethyl-2-phenyl-6-phenylbenzene-5-id-1-amine;yttrium has a molecular weight of 360.27 g/mol, XLogP of 4.68, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-phenyl-6-phenylbenzene-5-id-1-amine;yttrium is sourced from PubChem (CID 171607350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).