carbanide;3-methyl-2H-pyridin-2-ide;scandium

C7H9NSc-2 — CID 154538916

IUPACcarbanide;3-methyl-2H-pyridin-2-ide;scandium
SMILESCc1[c-]nccc1.[CH3-].[Sc]
InChIInChI=1S/C6H6N.CH3.Sc/c1-6-3-2-4-7-5-6;;/h2-4H,1H3;1H3;/q2*-1;
InChIKeyGCIVMRCZOGZJGM-UHFFFAOYSA-N
MW152.11 g/mol
LogP1.64
Rot. Bonds

About carbanide;3-methyl-2H-pyridin-2-ide;scandium

carbanide;3-methyl-2H-pyridin-2-ide;scandium (PubChem CID 154538916) has the molecular formula C7H9NSc-2 and a molecular weight of 152.11 g/mol. Its IUPAC name is carbanide;3-methyl-2H-pyridin-2-ide;scandium.

Molecular Properties

Compound Namecarbanide;3-methyl-2H-pyridin-2-ide;scandium
PubChem CID154538916
Molecular FormulaC7H9NSc-2
Molecular Weight152.11 g/mol
Exact Mass152.03
IUPAC Namecarbanide;3-methyl-2H-pyridin-2-ide;scandium
SMILESCc1[c-]nccc1.[CH3-].[Sc]
InChIInChI=1S/C6H6N.CH3.Sc/c1-6-3-2-4-7-5-6;;/h2-4H,1H3;1H3;/q2*-1;
InChIKeyGCIVMRCZOGZJGM-UHFFFAOYSA-N
XLogP1.64
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.11
LogP ≤ 51.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze carbanide;3-methyl-2H-pyridin-2-ide;scandium 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

carbanide;2-(2H-pyridin-2-id-3-yl)acetonitrile;vanadium;yttrium
CID 59265029
3-bromo-2H-pyridin-2-ide;bromozinc(1+)
CID 146002106
5-methyl-4H-pyrimidin-4-ide;yttrium(3+)
CID 23392087
1,3-dimethylbenzene-2-ide;titanium(3+);dichloride
CID 87514740
iridium(3+);bis(3-phenyl-2H-pyridin-2-ide)
CID 175918735
1,3-dimethylbenzene-2-ide;iron
CID 175995533
carbanide;methylbenzene;uranium(2+)
CID 20703759
zinc;methylbenzene;chloride
CID 22283008
5-tert-butyl-2-methylpyridine;5-tert-butyl-2-methylpyrimidine;3-tert-butyl-2H-pyridin-2-ide;methane;yttrium
CID 159075724
3,5-dimethyl-2H-pyridin-2-ide;rubidium(1+)
CID 88589673
7-methyl-8H-quinolin-8-ide;tungsten
CID 59855083
methylbenzene;tungsten
CID 58867867

Frequently Asked Questions

What is the IUPAC name of carbanide;3-methyl-2H-pyridin-2-ide;scandium?
The IUPAC name of carbanide;3-methyl-2H-pyridin-2-ide;scandium (CID 154538916) is carbanide;3-methyl-2H-pyridin-2-ide;scandium.
What is the SMILES notation for carbanide;3-methyl-2H-pyridin-2-ide;scandium?
The canonical SMILES for carbanide;3-methyl-2H-pyridin-2-ide;scandium is Cc1[c-]nccc1.[CH3-].[Sc].
What is the InChIKey of carbanide;3-methyl-2H-pyridin-2-ide;scandium?
The InChIKey is GCIVMRCZOGZJGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6N.CH3.Sc/c1-6-3-2-4-7-5-6;;/h2-4H,1H3;1H3;/q2*-1;.
What are the key properties of carbanide;3-methyl-2H-pyridin-2-ide;scandium?
carbanide;3-methyl-2H-pyridin-2-ide;scandium has a molecular weight of 152.11 g/mol, XLogP of 1.64, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for carbanide;3-methyl-2H-pyridin-2-ide;scandium is sourced from PubChem (CID 154538916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).