5-bromo-N,3-dimethyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium

C8H10BrN2Y- — CID 158154541

IUPAC5-bromo-N,3-dimethyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium
SMILESC=C1C(Br)=CC(C)=[C-]N1NC.[Y]
InChIInChI=1S/C8H10BrN2.Y/c1-6-4-8(9)7(2)11(5-6)10-3;/h4,10H,2H2,1,3H3;/q-1;
InChIKeySECOMYMQYMNDSX-UHFFFAOYSA-N
MW302.99 g/mol
LogP1.93
Rot. Bonds1

About 5-bromo-N,3-dimethyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium

5-bromo-N,3-dimethyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium (PubChem CID 158154541) has the molecular formula C8H10BrN2Y- and a molecular weight of 302.99 g/mol. Its IUPAC name is 5-bromo-N,3-dimethyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium.

Molecular Properties

Compound Name5-bromo-N,3-dimethyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium
PubChem CID158154541
Molecular FormulaC8H10BrN2Y-
Molecular Weight302.99 g/mol
Exact Mass301.91
IUPAC Name5-bromo-N,3-dimethyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium
SMILESC=C1C(Br)=CC(C)=[C-]N1NC.[Y]
InChIInChI=1S/C8H10BrN2.Y/c1-6-4-8(9)7(2)11(5-6)10-3;/h4,10H,2H2,1,3H3;/q-1;
InChIKeySECOMYMQYMNDSX-UHFFFAOYSA-N
XLogP1.93
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.99
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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-2H-pyridin-2-id-1-amine;yttrium
CID 147491046
5-fluoro-N,3-dimethyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium
CID 147857380
5-iodo-N,3-dimethyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium
CID 158214428
N,3-dimethyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium
CID 158408414
5-bromo-N,N,3-trimethyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium
CID 159984984
N,3,5-trimethyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium
CID 161134978
3-bromo-N,5-dimethyl-2-methylidenepyridin-1-amine
CID 158154542

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N,3-dimethyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium?
The IUPAC name of 5-bromo-N,3-dimethyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium (CID 158154541) is 5-bromo-N,3-dimethyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium.
What is the SMILES notation for 5-bromo-N,3-dimethyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium?
The canonical SMILES for 5-bromo-N,3-dimethyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium is C=C1C(Br)=CC(C)=[C-]N1NC.[Y].
What is the InChIKey of 5-bromo-N,3-dimethyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium?
The InChIKey is SECOMYMQYMNDSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10BrN2.Y/c1-6-4-8(9)7(2)11(5-6)10-3;/h4,10H,2H2,1,3H3;/q-1;.
What are the key properties of 5-bromo-N,3-dimethyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium?
5-bromo-N,3-dimethyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium has a molecular weight of 302.99 g/mol, XLogP of 1.93, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N,3-dimethyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium is sourced from PubChem (CID 158154541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).