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

C9H12IN2Y- — CID 162066316

IUPAC5-iodo-N,N,3-trimethyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium
SMILESC=C1C(I)=CC(C)=[C-]N1N(C)C.[Y]
InChIInChI=1S/C9H12IN2.Y/c1-7-5-9(10)8(2)12(6-7)11(3)4;/h5H,2H2,1,3-4H3;/q-1;
InChIKeySBWVXBMCYBCYFC-UHFFFAOYSA-N
MW364.02 g/mol
LogP2.32
Rot. Bonds1

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

5-iodo-N,N,3-trimethyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium (PubChem CID 162066316) has the molecular formula C9H12IN2Y- and a molecular weight of 364.02 g/mol. Its IUPAC name is 5-iodo-N,N,3-trimethyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium.

Molecular Properties

Compound Name5-iodo-N,N,3-trimethyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium
PubChem CID162066316
Molecular FormulaC9H12IN2Y-
Molecular Weight364.02 g/mol
Exact Mass363.91
IUPAC Name5-iodo-N,N,3-trimethyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium
SMILESC=C1C(I)=CC(C)=[C-]N1N(C)C.[Y]
InChIInChI=1S/C9H12IN2.Y/c1-7-5-9(10)8(2)12(6-7)11(3)4;/h5H,2H2,1,3-4H3;/q-1;
InChIKeySBWVXBMCYBCYFC-UHFFFAOYSA-N
XLogP2.32
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.02
LogP ≤ 52.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-ethyl-5-iodo-3-methyl-6-methylidene-2H-pyridin-2-ide;yttrium
CID 147960300
N,N,3-trimethyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium
CID 149050398
5-fluoro-N,N,3-trimethyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium
CID 158083782
5-iodo-N,3-dimethyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium
CID 158214428
N,N,3,5-tetramethyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium
CID 159654490
5-iodo-3-methyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium
CID 160736099
5-iodo-1,3-dimethyl-6-methylidene-2H-pyridin-2-ide;yttrium
CID 160920057
3-iodo-N,N,5-trimethyl-2-methylidenepyridin-1-amine
CID 162066317

Frequently Asked Questions

What is the IUPAC name of 5-iodo-N,N,3-trimethyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium?
The IUPAC name of 5-iodo-N,N,3-trimethyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium (CID 162066316) is 5-iodo-N,N,3-trimethyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium.
What is the SMILES notation for 5-iodo-N,N,3-trimethyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium?
The canonical SMILES for 5-iodo-N,N,3-trimethyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium is C=C1C(I)=CC(C)=[C-]N1N(C)C.[Y].
What is the InChIKey of 5-iodo-N,N,3-trimethyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium?
The InChIKey is SBWVXBMCYBCYFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12IN2.Y/c1-7-5-9(10)8(2)12(6-7)11(3)4;/h5H,2H2,1,3-4H3;/q-1;.
What are the key properties of 5-iodo-N,N,3-trimethyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium?
5-iodo-N,N,3-trimethyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium has a molecular weight of 364.02 g/mol, XLogP of 2.32, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-iodo-N,N,3-trimethyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium is sourced from PubChem (CID 162066316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).