5-iodo-3-methyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium

C7H8IN2Y- — CID 160736099

IUPAC5-iodo-3-methyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium
SMILESC=C1C(I)=CC(C)=[C-]N1N.[Y]
InChIInChI=1S/C7H8IN2.Y/c1-5-3-7(8)6(2)10(9)4-5;/h3H,2,9H2,1H3;/q-1;
InChIKeyWUZPTSLEURJWJH-UHFFFAOYSA-N
MW335.97 g/mol
LogP1.71
Rot. Bonds

About 5-iodo-3-methyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium

5-iodo-3-methyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium (PubChem CID 160736099) has the molecular formula C7H8IN2Y- and a molecular weight of 335.97 g/mol. Its IUPAC name is 5-iodo-3-methyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium.

Molecular Properties

Compound Name5-iodo-3-methyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium
PubChem CID160736099
Molecular FormulaC7H8IN2Y-
Molecular Weight335.97 g/mol
Exact Mass335.88
IUPAC Name5-iodo-3-methyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium
SMILESC=C1C(I)=CC(C)=[C-]N1N.[Y]
InChIInChI=1S/C7H8IN2.Y/c1-5-3-7(8)6(2)10(9)4-5;/h3H,2,9H2,1H3;/q-1;
InChIKeyWUZPTSLEURJWJH-UHFFFAOYSA-N
XLogP1.71
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.97
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-methyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium
CID 147720145
5-iodo-N,3-dimethyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium
CID 158214428
5-fluoro-3-methyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium
CID 159920056
3,5-dimethyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium
CID 160498349
5-iodo-N,N,3-trimethyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium
CID 162066316
3-Iodo-5-methyl-2-methylidenepyridin-1-amine
CID 160736100

Frequently Asked Questions

What is the IUPAC name of 5-iodo-3-methyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium?
The IUPAC name of 5-iodo-3-methyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium (CID 160736099) is 5-iodo-3-methyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium.
What is the SMILES notation for 5-iodo-3-methyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium?
The canonical SMILES for 5-iodo-3-methyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium is C=C1C(I)=CC(C)=[C-]N1N.[Y].
What is the InChIKey of 5-iodo-3-methyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium?
The InChIKey is WUZPTSLEURJWJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8IN2.Y/c1-5-3-7(8)6(2)10(9)4-5;/h3H,2,9H2,1H3;/q-1;.
What are the key properties of 5-iodo-3-methyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium?
5-iodo-3-methyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium has a molecular weight of 335.97 g/mol, XLogP of 1.71, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-iodo-3-methyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium is sourced from PubChem (CID 160736099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).