N,N,3-trimethyl-6-methylidene-5-(trifluoromethyl)-2H-pyridin-2-id-1-amine;yttrium

C10H12F3N2Y- — CID 160667563

IUPACN,N,3-trimethyl-6-methylidene-5-(trifluoromethyl)-2H-pyridin-2-id-1-amine;yttrium
SMILESC=C1C(C(F)(F)F)=CC(C)=[C-]N1N(C)C.[Y]
InChIInChI=1S/C10H12F3N2.Y/c1-7-5-9(10(11,12)13)8(2)15(6-7)14(3)4;/h5H,2H2,1,3-4H3;/q-1;
InChIKeyJYBDFRKNBPUIIY-UHFFFAOYSA-N
MW306.12 g/mol
LogP2.49
Rot. Bonds1

About N,N,3-trimethyl-6-methylidene-5-(trifluoromethyl)-2H-pyridin-2-id-1-amine;yttrium

N,N,3-trimethyl-6-methylidene-5-(trifluoromethyl)-2H-pyridin-2-id-1-amine;yttrium (PubChem CID 160667563) has the molecular formula C10H12F3N2Y- and a molecular weight of 306.12 g/mol. Its IUPAC name is N,N,3-trimethyl-6-methylidene-5-(trifluoromethyl)-2H-pyridin-2-id-1-amine;yttrium.

Molecular Properties

Compound NameN,N,3-trimethyl-6-methylidene-5-(trifluoromethyl)-2H-pyridin-2-id-1-amine;yttrium
PubChem CID160667563
Molecular FormulaC10H12F3N2Y-
Molecular Weight306.12 g/mol
Exact Mass306.00
IUPAC NameN,N,3-trimethyl-6-methylidene-5-(trifluoromethyl)-2H-pyridin-2-id-1-amine;yttrium
SMILESC=C1C(C(F)(F)F)=CC(C)=[C-]N1N(C)C.[Y]
InChIInChI=1S/C10H12F3N2.Y/c1-7-5-9(10(11,12)13)8(2)15(6-7)14(3)4;/h5H,2H2,1,3-4H3;/q-1;
InChIKeyJYBDFRKNBPUIIY-UHFFFAOYSA-N
XLogP2.49
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.12
LogP ≤ 52.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

5-(1,1-difluoroethyl)-4-ethenyl-1,2-dimethyl-3H-pyrazole
CID 134466447
1-(2,2-difluoroethyl)-3-methyl-6-methylidene-5-(trifluoromethyl)-2H-pyridin-2-ide;yttrium
CID 157808206
1,3-dimethyl-6-methylidene-5-(trifluoromethyl)-2H-pyridin-2-ide;yttrium
CID 158142944
3,5-dimethyl-6-methylidene-1-(2,2,2-trifluoroethyl)-2H-pyridin-2-ide;yttrium
CID 160247595
3-methyl-6-methylidene-1-(2,2,2-trifluoroethyl)-5-(trifluoromethyl)-2H-pyridin-2-ide;yttrium
CID 160250415
3-methyl-6-methylidene-5-(trifluoromethyl)-2H-pyridin-2-id-1-amine;yttrium
CID 160530658
1-ethyl-3-methyl-6-methylidene-5-(trifluoromethyl)-2H-pyridin-2-ide;yttrium
CID 161375551
N,3-dimethyl-6-methylidene-5-(trifluoromethyl)-2H-pyridin-2-id-1-amine;yttrium
CID 161823291
N,N-dimethyl-2-methylidene-5-(trifluoromethyl)pyridin-1-amine
CID 163687782
3-fluoro-N,N,5-trimethyl-2-methylidenepyridin-1-amine
CID 158083783
3-(Difluoromethyl)-5-methyl-2-methylidenepyridin-1-amine
CID 159515003
5-Methyl-2-methylidene-3-(trifluoromethyl)pyridin-1-amine
CID 160530659

Frequently Asked Questions

What is the IUPAC name of N,N,3-trimethyl-6-methylidene-5-(trifluoromethyl)-2H-pyridin-2-id-1-amine;yttrium?
The IUPAC name of N,N,3-trimethyl-6-methylidene-5-(trifluoromethyl)-2H-pyridin-2-id-1-amine;yttrium (CID 160667563) is N,N,3-trimethyl-6-methylidene-5-(trifluoromethyl)-2H-pyridin-2-id-1-amine;yttrium.
What is the SMILES notation for N,N,3-trimethyl-6-methylidene-5-(trifluoromethyl)-2H-pyridin-2-id-1-amine;yttrium?
The canonical SMILES for N,N,3-trimethyl-6-methylidene-5-(trifluoromethyl)-2H-pyridin-2-id-1-amine;yttrium is C=C1C(C(F)(F)F)=CC(C)=[C-]N1N(C)C.[Y].
What is the InChIKey of N,N,3-trimethyl-6-methylidene-5-(trifluoromethyl)-2H-pyridin-2-id-1-amine;yttrium?
The InChIKey is JYBDFRKNBPUIIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12F3N2.Y/c1-7-5-9(10(11,12)13)8(2)15(6-7)14(3)4;/h5H,2H2,1,3-4H3;/q-1;.
What are the key properties of N,N,3-trimethyl-6-methylidene-5-(trifluoromethyl)-2H-pyridin-2-id-1-amine;yttrium?
N,N,3-trimethyl-6-methylidene-5-(trifluoromethyl)-2H-pyridin-2-id-1-amine;yttrium has a molecular weight of 306.12 g/mol, XLogP of 2.49, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,3-trimethyl-6-methylidene-5-(trifluoromethyl)-2H-pyridin-2-id-1-amine;yttrium is sourced from PubChem (CID 160667563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).