N-methyl-N-phenylaniline;yttrium

C13H11NY-2 — CID 59953259

IUPACN-methyl-N-phenylaniline;yttrium
SMILESCN(c1[c-]cccc1)c1[c-]cccc1.[Y]
InChIInChI=1S/C13H11N.Y/c1-14(12-8-4-2-5-9-12)13-10-6-3-7-11-13;/h2-8,10H,1H3;/q-2;
InChIKeyNZGATOQGWLRSPM-UHFFFAOYSA-N
MW270.14 g/mol
LogP3.05
Rot. Bonds2

About N-methyl-N-phenylaniline;yttrium

N-methyl-N-phenylaniline;yttrium (PubChem CID 59953259) has the molecular formula C13H11NY-2 and a molecular weight of 270.14 g/mol. Its IUPAC name is N-methyl-N-phenylaniline;yttrium.

Molecular Properties

Compound NameN-methyl-N-phenylaniline;yttrium
PubChem CID59953259
Molecular FormulaC13H11NY-2
Molecular Weight270.14 g/mol
Exact Mass270.00
IUPAC NameN-methyl-N-phenylaniline;yttrium
SMILESCN(c1[c-]cccc1)c1[c-]cccc1.[Y]
InChIInChI=1S/C13H11N.Y/c1-14(12-8-4-2-5-9-12)13-10-6-3-7-11-13;/h2-8,10H,1H3;/q-2;
InChIKeyNZGATOQGWLRSPM-UHFFFAOYSA-N
XLogP3.05
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.14
LogP ≤ 53.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

ethane;phenylbenzene;yttrium
CID 161119758
3-(N-methylanilino)propanenitrile;tris(yttrium)
CID 58860588
chloroplatinum(1+);N,N-dimethylaniline;bis(triphenylphosphanium)
CID 6397321
palladium(2+);phenylbenzene
CID 58471959
iridium;phenylbenzene
CID 58599975
zinc;methylbenzene;chloride
CID 22283008
N-ethenyl-N-methylaniline;ethylidene-methyl-phenylazanium;methane;bis(yttrium)
CID 169428658
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
tris(N,N-dimethyl-2-phenylpropan-2-amine);gadolinium(3+)
CID 135085147
propan-2-ylbenzene;yttrium
CID 58365433
methylbenzene;praseodymium
CID 59896436
iron;methylbenzene
CID 134850166

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-phenylaniline;yttrium?
The IUPAC name of N-methyl-N-phenylaniline;yttrium (CID 59953259) is N-methyl-N-phenylaniline;yttrium.
What is the SMILES notation for N-methyl-N-phenylaniline;yttrium?
The canonical SMILES for N-methyl-N-phenylaniline;yttrium is CN(c1[c-]cccc1)c1[c-]cccc1.[Y].
What is the InChIKey of N-methyl-N-phenylaniline;yttrium?
The InChIKey is NZGATOQGWLRSPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11N.Y/c1-14(12-8-4-2-5-9-12)13-10-6-3-7-11-13;/h2-8,10H,1H3;/q-2;.
What are the key properties of N-methyl-N-phenylaniline;yttrium?
N-methyl-N-phenylaniline;yttrium has a molecular weight of 270.14 g/mol, XLogP of 3.05, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-phenylaniline;yttrium is sourced from PubChem (CID 59953259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).