carbanide;chlororuthenium(1+);4-ethyl-2-(4-ethyl-2-pyridinyl)pyridine

C15H19ClN2Ru — CID 58510490

IUPACcarbanide;chlororuthenium(1+);4-ethyl-2-(4-ethyl-2-pyridinyl)pyridine
SMILESCCc1ccnc(-c2cc(CC)ccn2)c1.Cl[Ru+].[CH3-]
InChIInChI=1S/C14H16N2.CH3.ClH.Ru/c1-3-11-5-7-15-13(9-11)14-10-12(4-2)6-8-16-14;;;/h5-10H,3-4H2,1-2H3;1H3;1H;/q;-1;;+2/p-1
InChIKeyYGTVIRPKTRSBKF-UHFFFAOYSA-M
MW363.85 g/mol
LogP4.41
Rot. Bonds3

About carbanide;chlororuthenium(1+);4-ethyl-2-(4-ethyl-2-pyridinyl)pyridine

carbanide;chlororuthenium(1+);4-ethyl-2-(4-ethyl-2-pyridinyl)pyridine (PubChem CID 58510490) has the molecular formula C15H19ClN2Ru and a molecular weight of 363.85 g/mol. Its IUPAC name is carbanide;chlororuthenium(1+);4-ethyl-2-(4-ethyl-2-pyridinyl)pyridine.

Molecular Properties

Compound Namecarbanide;chlororuthenium(1+);4-ethyl-2-(4-ethyl-2-pyridinyl)pyridine
PubChem CID58510490
Molecular FormulaC15H19ClN2Ru
Molecular Weight363.85 g/mol
Exact Mass364.03
IUPAC Namecarbanide;chlororuthenium(1+);4-ethyl-2-(4-ethyl-2-pyridinyl)pyridine
SMILESCCc1ccnc(-c2cc(CC)ccn2)c1.Cl[Ru+].[CH3-]
InChIInChI=1S/C14H16N2.CH3.ClH.Ru/c1-3-11-5-7-15-13(9-11)14-10-12(4-2)6-8-16-14;;;/h5-10H,3-4H2,1-2H3;1H3;1H;/q;-1;;+2/p-1
InChIKeyYGTVIRPKTRSBKF-UHFFFAOYSA-M
XLogP4.41
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.85
LogP ≤ 54.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze carbanide;chlororuthenium(1+);4-ethyl-2-(4-ethyl-2-pyridinyl)pyridine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of carbanide;chlororuthenium(1+);4-ethyl-2-(4-ethyl-2-pyridinyl)pyridine?
The IUPAC name of carbanide;chlororuthenium(1+);4-ethyl-2-(4-ethyl-2-pyridinyl)pyridine (CID 58510490) is carbanide;chlororuthenium(1+);4-ethyl-2-(4-ethyl-2-pyridinyl)pyridine.
What is the SMILES notation for carbanide;chlororuthenium(1+);4-ethyl-2-(4-ethyl-2-pyridinyl)pyridine?
The canonical SMILES for carbanide;chlororuthenium(1+);4-ethyl-2-(4-ethyl-2-pyridinyl)pyridine is CCc1ccnc(-c2cc(CC)ccn2)c1.Cl[Ru+].[CH3-].
What is the InChIKey of carbanide;chlororuthenium(1+);4-ethyl-2-(4-ethyl-2-pyridinyl)pyridine?
The InChIKey is YGTVIRPKTRSBKF-UHFFFAOYSA-M. The full InChI is InChI=1S/C14H16N2.CH3.ClH.Ru/c1-3-11-5-7-15-13(9-11)14-10-12(4-2)6-8-16-14;;;/h5-10H,3-4H2,1-2H3;1H3;1H;/q;-1;;+2/p-1.
What are the key properties of carbanide;chlororuthenium(1+);4-ethyl-2-(4-ethyl-2-pyridinyl)pyridine?
carbanide;chlororuthenium(1+);4-ethyl-2-(4-ethyl-2-pyridinyl)pyridine has a molecular weight of 363.85 g/mol, XLogP of 4.41, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for carbanide;chlororuthenium(1+);4-ethyl-2-(4-ethyl-2-pyridinyl)pyridine is sourced from PubChem (CID 58510490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).