5-bromo-1,3-dimethyl-6-methylidene-2H-pyridin-2-ide;yttrium

C8H9BrNY- — CID 148863106

IUPAC5-bromo-1,3-dimethyl-6-methylidene-2H-pyridin-2-ide;yttrium
SMILESC=C1C(Br)=CC(C)=[C-]N1C.[Y]
InChIInChI=1S/C8H9BrN.Y/c1-6-4-8(9)7(2)10(3)5-6;/h4H,2H2,1,3H3;/q-1;
InChIKeyKPQZOKNPDYFTMI-UHFFFAOYSA-N
MW287.98 g/mol
LogP2.43
Rot. Bonds

About 5-bromo-1,3-dimethyl-6-methylidene-2H-pyridin-2-ide;yttrium

5-bromo-1,3-dimethyl-6-methylidene-2H-pyridin-2-ide;yttrium (PubChem CID 148863106) has the molecular formula C8H9BrNY- and a molecular weight of 287.98 g/mol. Its IUPAC name is 5-bromo-1,3-dimethyl-6-methylidene-2H-pyridin-2-ide;yttrium.

Molecular Properties

Compound Name5-bromo-1,3-dimethyl-6-methylidene-2H-pyridin-2-ide;yttrium
PubChem CID148863106
Molecular FormulaC8H9BrNY-
Molecular Weight287.98 g/mol
Exact Mass286.90
IUPAC Name5-bromo-1,3-dimethyl-6-methylidene-2H-pyridin-2-ide;yttrium
SMILESC=C1C(Br)=CC(C)=[C-]N1C.[Y]
InChIInChI=1S/C8H9BrN.Y/c1-6-4-8(9)7(2)10(3)5-6;/h4H,2H2,1,3H3;/q-1;
InChIKeyKPQZOKNPDYFTMI-UHFFFAOYSA-N
XLogP2.43
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.98
LogP ≤ 52.43
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

5-bromo-3-methyl-6-methylidene-1-(2,2,2-trifluoroethyl)-2H-pyridin-2-ide;yttrium
CID 161297791
N,N,3-trimethylbenzene-5-id-1-amine;yttrium
CID 58336188
3-ethyl-N,N-dimethylbenzene-5-id-1-amine;yttrium
CID 58336289
N-ethyl-N,3,4-trimethylbenzene-6-id-1-amine;tridecakis(yttrium)
CID 58625893
N,N,3-trimethylbenzene-4-id-1-amine;yttrium
CID 59870101
4-bromo-1,5,6-trimethyl-2H-pyridine
CID 141279725
(2Z)-5-bromo-1,3-dimethyl-2-prop-2-enylidenepyridine
CID 143938742
(3E)-5-bromo-N,N,2-trimethylhexa-1,3,5-trien-3-amine;ethane
CID 144534702
1,3-dimethyl-6-methylidene-2H-pyridin-2-ide;yttrium
CID 147635783
1,3,5-trimethyl-6-methylidene-2H-pyridin-2-ide;yttrium
CID 147736665
5-fluoro-1,3-dimethyl-6-methylidene-2H-pyridin-2-ide;yttrium
CID 148998663
5-bromo-1-butyl-3-methyl-6-methylidene-2H-pyridin-2-ide;yttrium
CID 149570537

Frequently Asked Questions

What is the IUPAC name of 5-bromo-1,3-dimethyl-6-methylidene-2H-pyridin-2-ide;yttrium?
The IUPAC name of 5-bromo-1,3-dimethyl-6-methylidene-2H-pyridin-2-ide;yttrium (CID 148863106) is 5-bromo-1,3-dimethyl-6-methylidene-2H-pyridin-2-ide;yttrium.
What is the SMILES notation for 5-bromo-1,3-dimethyl-6-methylidene-2H-pyridin-2-ide;yttrium?
The canonical SMILES for 5-bromo-1,3-dimethyl-6-methylidene-2H-pyridin-2-ide;yttrium is C=C1C(Br)=CC(C)=[C-]N1C.[Y].
What is the InChIKey of 5-bromo-1,3-dimethyl-6-methylidene-2H-pyridin-2-ide;yttrium?
The InChIKey is KPQZOKNPDYFTMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9BrN.Y/c1-6-4-8(9)7(2)10(3)5-6;/h4H,2H2,1,3H3;/q-1;.
What are the key properties of 5-bromo-1,3-dimethyl-6-methylidene-2H-pyridin-2-ide;yttrium?
5-bromo-1,3-dimethyl-6-methylidene-2H-pyridin-2-ide;yttrium has a molecular weight of 287.98 g/mol, XLogP of 2.43, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-1,3-dimethyl-6-methylidene-2H-pyridin-2-ide;yttrium is sourced from PubChem (CID 148863106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).