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

C9H13N2Y- — CID 161134978

IUPACN,3,5-trimethyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium
SMILESC=C1C(C)=CC(C)=[C-]N1NC.[Y]
InChIInChI=1S/C9H13N2.Y/c1-7-5-8(2)9(3)11(6-7)10-4;/h5,10H,3H2,1-2,4H3;/q-1;
InChIKeyVQHNMNIQNPHTQY-UHFFFAOYSA-N
MW238.12 g/mol
LogP1.60
Rot. Bonds1

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

N,3,5-trimethyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium (PubChem CID 161134978) has the molecular formula C9H13N2Y- and a molecular weight of 238.12 g/mol. Its IUPAC name is N,3,5-trimethyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium.

Molecular Properties

Compound NameN,3,5-trimethyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium
PubChem CID161134978
Molecular FormulaC9H13N2Y-
Molecular Weight238.12 g/mol
Exact Mass238.01
IUPAC NameN,3,5-trimethyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium
SMILESC=C1C(C)=CC(C)=[C-]N1NC.[Y]
InChIInChI=1S/C9H13N2.Y/c1-7-5-8(2)9(3)11(6-7)10-4;/h5,10H,3H2,1-2,4H3;/q-1;
InChIKeyVQHNMNIQNPHTQY-UHFFFAOYSA-N
XLogP1.60
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.12
LogP ≤ 51.60
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

N,3-dimethyl-6-methylidene-5-(trifluoromethyl)-2H-pyridin-2-id-1-amine;yttrium
CID 161823291
3-fluoro-N,5-dimethyl-2-methylidenepyridin-1-amine
CID 147857381
1-Methyl-1-(4-methylbenzene-5-id-1-yl)hydrazine;yttrium
CID 58512384
1-Methyl-2,3,4,8-tetrahydro-1,2-benzodiazepine
CID 69986764
1,3-dimethyl-6-methylidene-2H-indazole
CID 123884740
1,2-dimethyl-1-[(2Z)-4-methylpenta-2,4-dien-2-yl]hydrazine;ethane
CID 144233908
ethane;1-(7-ethenyl-6-methyl-2-methylidene-3H-azepin-1-yl)-1,2-dimethylhydrazine
CID 144512418
2,3,5-trimethyl-1H-pyridazine
CID 146392503
5-ethynyl-N,3-dimethyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium
CID 147049295
3-methyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium
CID 147720145
5-fluoro-N,3-dimethyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium
CID 147857380
5-bromo-N,3-dimethyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium
CID 158154541

Frequently Asked Questions

What is the IUPAC name of N,3,5-trimethyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium?
The IUPAC name of N,3,5-trimethyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium (CID 161134978) is N,3,5-trimethyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium.
What is the SMILES notation for N,3,5-trimethyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium?
The canonical SMILES for N,3,5-trimethyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium is C=C1C(C)=CC(C)=[C-]N1NC.[Y].
What is the InChIKey of N,3,5-trimethyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium?
The InChIKey is VQHNMNIQNPHTQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N2.Y/c1-7-5-8(2)9(3)11(6-7)10-4;/h5,10H,3H2,1-2,4H3;/q-1;.
What are the key properties of N,3,5-trimethyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium?
N,3,5-trimethyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium has a molecular weight of 238.12 g/mol, XLogP of 1.60, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,3,5-trimethyl-6-methylidene-2H-pyridin-2-id-1-amine;yttrium is sourced from PubChem (CID 161134978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).