carbanide;ethane;imidazo[1,2-a]pyridine;imidazo[1,2-a]pyrimidine;bis(yttrium)

C19H29N5Y2-2 — CID 159110066

IUPACcarbanide;ethane;imidazo[1,2-a]pyridine;imidazo[1,2-a]pyrimidine;bis(yttrium)
SMILESCC.CC.[CH3-].[CH3-].[Y].[Y].c1ccn2ccnc2c1.c1cnc2nccn2c1
InChIInChI=1S/C7H6N2.C6H5N3.2C2H6.2CH3.2Y/c1-2-5-9-6-4-8-7(9)3-1;1-2-7-6-8-3-5-9(6)4-1;2*1-2;;;;/h1-6H;1-5H;2*1-2H3;2*1H3;;/q;;;;2*-1;;
InChIKeyLMWGIOJTKARXDT-UHFFFAOYSA-N
MW505.29 g/mol
LogP5.01
Rot. Bonds

About carbanide;ethane;imidazo[1,2-a]pyridine;imidazo[1,2-a]pyrimidine;bis(yttrium)

carbanide;ethane;imidazo[1,2-a]pyridine;imidazo[1,2-a]pyrimidine;bis(yttrium) (PubChem CID 159110066) has the molecular formula C19H29N5Y2-2 and a molecular weight of 505.29 g/mol. Its IUPAC name is carbanide;ethane;imidazo[1,2-a]pyridine;imidazo[1,2-a]pyrimidine;bis(yttrium).

Molecular Properties

Compound Namecarbanide;ethane;imidazo[1,2-a]pyridine;imidazo[1,2-a]pyrimidine;bis(yttrium)
PubChem CID159110066
Molecular FormulaC19H29N5Y2-2
Molecular Weight505.29 g/mol
Exact Mass505.06
IUPAC Namecarbanide;ethane;imidazo[1,2-a]pyridine;imidazo[1,2-a]pyrimidine;bis(yttrium)
SMILESCC.CC.[CH3-].[CH3-].[Y].[Y].c1ccn2ccnc2c1.c1cnc2nccn2c1
InChIInChI=1S/C7H6N2.C6H5N3.2C2H6.2CH3.2Y/c1-2-5-9-6-4-8-7(9)3-1;1-2-7-6-8-3-5-9(6)4-1;2*1-2;;;;/h1-6H;1-5H;2*1-2H3;2*1H3;;/q;;;;2*-1;;
InChIKeyLMWGIOJTKARXDT-UHFFFAOYSA-N
XLogP5.01
TPSA47.49 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms26
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500505.29
LogP ≤ 55.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

ethane;bis(imidazo[1,2-a]pyrimidine)
CID 161252419
imidazo[1,2-a]pyrimidine
CID 577018
imidazo[1,2-a]pyridine;phenylmethanamine
CID 67154135
imidazo[1,2-a]pyridine;imidazo[1,2-a]pyrimidine;imidazo[2,1-b][1,3,4]thiadiazole;imidazo[2,1-b][1,3]thiazole;imidazo[1,2-c]pyrimidine
CID 19832713
N-methyl-N-phenylimidazo[1,2-a]pyridin-6-amine
CID 91458795
icosakis(2,2-dimethylpropane);imidazo[1,2-a]pyrazine;imidazo[1,2-a]pyridine;imidazo[1,2-a]pyrimidine;imidazo[1,2-b]pyridazine;imidazo[1,2-c]pyrimidine;indolizine;methane;pyrazolo[1,5-a]pyrazine;pyrazolo[1,5-a]pyridine;pyrazolo[1,5-a]pyrimidine;pyrazolo[1,5-b]pyridazine;pyrazolo[1,5-c]pyrimidine;bis(pyrrolo[1,2-a]pyrazine);bis(pyrrolo[1,2-a]pyrimidine);bis(pyrrolo[1,2-b]pyridazine);bis(pyrrolo[1,2-c]pyrimidine)
CID 158842149
pyrimido[1,2-a]pyrimidin-2-one
CID 13114303
7-imidazo[1,2-a]pyridin-2-ylimidazo[1,2-c]pyrimidine
CID 139315871
imidazo[1,2-a]pyridine;1H-imidazo[1,2-a]pyrimidin-4-ium;1H-imidazo[1,2-c]pyrimidin-4-ium
CID 158438415
imidazo[1,2-a]azepin-7-one
CID 12692689
1H-benzimidazole;ethane;imidazo[1,2-a]pyridine;1-methyl-3H-indol-2-one
CID 142473212
ethane;6-ethylimidazo[1,2-a]pyridine
CID 142917283

Frequently Asked Questions

What is the IUPAC name of carbanide;ethane;imidazo[1,2-a]pyridine;imidazo[1,2-a]pyrimidine;bis(yttrium)?
The IUPAC name of carbanide;ethane;imidazo[1,2-a]pyridine;imidazo[1,2-a]pyrimidine;bis(yttrium) (CID 159110066) is carbanide;ethane;imidazo[1,2-a]pyridine;imidazo[1,2-a]pyrimidine;bis(yttrium).
What is the SMILES notation for carbanide;ethane;imidazo[1,2-a]pyridine;imidazo[1,2-a]pyrimidine;bis(yttrium)?
The canonical SMILES for carbanide;ethane;imidazo[1,2-a]pyridine;imidazo[1,2-a]pyrimidine;bis(yttrium) is CC.CC.[CH3-].[CH3-].[Y].[Y].c1ccn2ccnc2c1.c1cnc2nccn2c1.
What is the InChIKey of carbanide;ethane;imidazo[1,2-a]pyridine;imidazo[1,2-a]pyrimidine;bis(yttrium)?
The InChIKey is LMWGIOJTKARXDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6N2.C6H5N3.2C2H6.2CH3.2Y/c1-2-5-9-6-4-8-7(9)3-1;1-2-7-6-8-3-5-9(6)4-1;2*1-2;;;;/h1-6H;1-5H;2*1-2H3;2*1H3;;/q;;;;2*-1;;.
What are the key properties of carbanide;ethane;imidazo[1,2-a]pyridine;imidazo[1,2-a]pyrimidine;bis(yttrium)?
carbanide;ethane;imidazo[1,2-a]pyridine;imidazo[1,2-a]pyrimidine;bis(yttrium) has a molecular weight of 505.29 g/mol, XLogP of 5.01, 0 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for carbanide;ethane;imidazo[1,2-a]pyridine;imidazo[1,2-a]pyrimidine;bis(yttrium) is sourced from PubChem (CID 159110066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).