N-(4-methyl-2H-pyridin-2-id-3-yl)propan-1-imine;tungsten(2+)

C9H10N2W — CID 59567153

IUPACN-(4-methyl-2H-pyridin-2-id-3-yl)propan-1-imine;tungsten(2+)
SMILESCC/[C-]=N/c1[c-]nccc1C.[W+2]
InChIInChI=1S/C9H10N2.W/c1-3-5-11-9-7-10-6-4-8(9)2;/h4,6H,3H2,1-2H3;/q-2;+2
InChIKeyNJHRXUTWMZUABJ-UHFFFAOYSA-N
MW330.03 g/mol
LogP2.18
Rot. Bonds2

About N-(4-methyl-2H-pyridin-2-id-3-yl)propan-1-imine;tungsten(2+)

N-(4-methyl-2H-pyridin-2-id-3-yl)propan-1-imine;tungsten(2+) (PubChem CID 59567153) has the molecular formula C9H10N2W and a molecular weight of 330.03 g/mol. Its IUPAC name is N-(4-methyl-2H-pyridin-2-id-3-yl)propan-1-imine;tungsten(2+).

Molecular Properties

Compound NameN-(4-methyl-2H-pyridin-2-id-3-yl)propan-1-imine;tungsten(2+)
PubChem CID59567153
Molecular FormulaC9H10N2W
Molecular Weight330.03 g/mol
Exact Mass330.04
IUPAC NameN-(4-methyl-2H-pyridin-2-id-3-yl)propan-1-imine;tungsten(2+)
SMILESCC/[C-]=N/c1[c-]nccc1C.[W+2]
InChIInChI=1S/C9H10N2.W/c1-3-5-11-9-7-10-6-4-8(9)2;/h4,6H,3H2,1-2H3;/q-2;+2
InChIKeyNJHRXUTWMZUABJ-UHFFFAOYSA-N
XLogP2.18
TPSA25.25 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.03
LogP ≤ 52.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

Analyze N-(4-methyl-2H-pyridin-2-id-3-yl)propan-1-imine;tungsten(2+) with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2-methyl-4H-pyridin-4-id-3-yl)propan-1-imine;tungsten(2+)
CID 59567148
N-(4-methyl-3H-pyridin-3-id-2-yl)propan-1-imine;tungsten(2+)
CID 59659044
N-(2-methyl-3H-pyridin-3-id-4-yl)propan-1-imine;tungsten(2+)
CID 59659048
ethane;N-(4-methyl-2H-pyridin-2-id-3-yl)propan-1-imine;tungsten(2+)
CID 158162413
ethane;N-(2-methyl-3H-pyridin-3-id-4-yl)propan-1-imine;tungsten(2+)
CID 161040505
ethane;N-(2-methyl-4H-pyridin-4-id-3-yl)propan-1-imine;tungsten(2+)
CID 161750758

Frequently Asked Questions

What is the IUPAC name of N-(4-methyl-2H-pyridin-2-id-3-yl)propan-1-imine;tungsten(2+)?
The IUPAC name of N-(4-methyl-2H-pyridin-2-id-3-yl)propan-1-imine;tungsten(2+) (CID 59567153) is N-(4-methyl-2H-pyridin-2-id-3-yl)propan-1-imine;tungsten(2+).
What is the SMILES notation for N-(4-methyl-2H-pyridin-2-id-3-yl)propan-1-imine;tungsten(2+)?
The canonical SMILES for N-(4-methyl-2H-pyridin-2-id-3-yl)propan-1-imine;tungsten(2+) is CC/[C-]=N/c1[c-]nccc1C.[W+2].
What is the InChIKey of N-(4-methyl-2H-pyridin-2-id-3-yl)propan-1-imine;tungsten(2+)?
The InChIKey is NJHRXUTWMZUABJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2.W/c1-3-5-11-9-7-10-6-4-8(9)2;/h4,6H,3H2,1-2H3;/q-2;+2.
What are the key properties of N-(4-methyl-2H-pyridin-2-id-3-yl)propan-1-imine;tungsten(2+)?
N-(4-methyl-2H-pyridin-2-id-3-yl)propan-1-imine;tungsten(2+) has a molecular weight of 330.03 g/mol, XLogP of 2.18, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methyl-2H-pyridin-2-id-3-yl)propan-1-imine;tungsten(2+) is sourced from PubChem (CID 59567153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).