2-chloro-5-methyl-3H-pyridin-3-ide;yttrium

C6H5ClNY- — CID 58056992

IUPAC2-chloro-5-methyl-3H-pyridin-3-ide;yttrium
SMILESCc1c[c-]c(Cl)nc1.[Y]
InChIInChI=1S/C6H5ClN.Y/c1-5-2-3-6(7)8-4-5;/h2,4H,1H3;/q-1;
InChIKeyVXPUSBHCERHUKF-UHFFFAOYSA-N
MW215.47 g/mol
LogP1.84
Rot. Bonds

About 2-chloro-5-methyl-3H-pyridin-3-ide;yttrium

2-chloro-5-methyl-3H-pyridin-3-ide;yttrium (PubChem CID 58056992) has the molecular formula C6H5ClNY- and a molecular weight of 215.47 g/mol. Its IUPAC name is 2-chloro-5-methyl-3H-pyridin-3-ide;yttrium.

Molecular Properties

Compound Name2-chloro-5-methyl-3H-pyridin-3-ide;yttrium
PubChem CID58056992
Molecular FormulaC6H5ClNY-
Molecular Weight215.47 g/mol
Exact Mass214.92
IUPAC Name2-chloro-5-methyl-3H-pyridin-3-ide;yttrium
SMILESCc1c[c-]c(Cl)nc1.[Y]
InChIInChI=1S/C6H5ClN.Y/c1-5-2-3-6(7)8-4-5;/h2,4H,1H3;/q-1;
InChIKeyVXPUSBHCERHUKF-UHFFFAOYSA-N
XLogP1.84
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.47
LogP ≤ 51.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

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Related Compounds

5-methyl-2H-pyridin-2-ide;yttrium
CID 58607063
5-methyl-3H-pyridin-3-ide;yttrium
CID 58618531
magnesium;5-methyl-2H-pyridin-2-ide;chloride
CID 58872235
5-(1-chloroethyl)-2H-pyridin-2-ide;yttrium
CID 59218627
5-(chloromethyl)-2H-pyridin-2-ide;yttrium
CID 59218630
2-chloro-5-methyl-3H-pyridin-3-ide;zinc
CID 145786563
5-methyl-3H-pyridin-3-ide;rutherfordium
CID 153587996
5-methyl-2H-pyridin-2-ide;rutherfordium
CID 153588258
2-chloro-5-methyl-4H-pyridin-4-ide;yttrium
CID 168176729
2-chloro-5-methyl-4H-pyridin-4-ide;ethane;yttrium
CID 168177012
2-chloro-5-propan-2-yl-4H-pyridin-4-ide;yttrium
CID 176600289
5-methyl-2H-pyridin-2-ide;yttrium(3+)
CID 21019741

Frequently Asked Questions

What is the IUPAC name of 2-chloro-5-methyl-3H-pyridin-3-ide;yttrium?
The IUPAC name of 2-chloro-5-methyl-3H-pyridin-3-ide;yttrium (CID 58056992) is 2-chloro-5-methyl-3H-pyridin-3-ide;yttrium.
What is the SMILES notation for 2-chloro-5-methyl-3H-pyridin-3-ide;yttrium?
The canonical SMILES for 2-chloro-5-methyl-3H-pyridin-3-ide;yttrium is Cc1c[c-]c(Cl)nc1.[Y].
What is the InChIKey of 2-chloro-5-methyl-3H-pyridin-3-ide;yttrium?
The InChIKey is VXPUSBHCERHUKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5ClN.Y/c1-5-2-3-6(7)8-4-5;/h2,4H,1H3;/q-1;.
What are the key properties of 2-chloro-5-methyl-3H-pyridin-3-ide;yttrium?
2-chloro-5-methyl-3H-pyridin-3-ide;yttrium has a molecular weight of 215.47 g/mol, XLogP of 1.84, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-5-methyl-3H-pyridin-3-ide;yttrium is sourced from PubChem (CID 58056992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).