ethane;1-methyl-5H-1,6-naphthyridin-5-id-2-one;ruthenium(1+)

C11H13N2ORu — CID 170592021

IUPACethane;1-methyl-5H-1,6-naphthyridin-5-id-2-one;ruthenium(1+)
SMILESCC.Cn1c(=O)ccc2[c-]nccc21.[Ru+]
InChIInChI=1S/C9H7N2O.C2H6.Ru/c1-11-8-4-5-10-6-7(8)2-3-9(11)12;1-2;/h2-5H,1H3;1-2H3;/q-1;;+1
InChIKeyKSMHKDHGUMSWFI-UHFFFAOYSA-N
MW290.31 g/mol
LogP1.76
Rot. Bonds

About ethane;1-methyl-5H-1,6-naphthyridin-5-id-2-one;ruthenium(1+)

ethane;1-methyl-5H-1,6-naphthyridin-5-id-2-one;ruthenium(1+) (PubChem CID 170592021) has the molecular formula C11H13N2ORu and a molecular weight of 290.31 g/mol. Its IUPAC name is ethane;1-methyl-5H-1,6-naphthyridin-5-id-2-one;ruthenium(1+).

Molecular Properties

Compound Nameethane;1-methyl-5H-1,6-naphthyridin-5-id-2-one;ruthenium(1+)
PubChem CID170592021
Molecular FormulaC11H13N2ORu
Molecular Weight290.31 g/mol
Exact Mass291.01
IUPAC Nameethane;1-methyl-5H-1,6-naphthyridin-5-id-2-one;ruthenium(1+)
SMILESCC.Cn1c(=O)ccc2[c-]nccc21.[Ru+]
InChIInChI=1S/C9H7N2O.C2H6.Ru/c1-11-8-4-5-10-6-7(8)2-3-9(11)12;1-2;/h2-5H,1H3;1-2H3;/q-1;;+1
InChIKeyKSMHKDHGUMSWFI-UHFFFAOYSA-N
XLogP1.76
TPSA34.89 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.31
LogP ≤ 51.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-Methylquinolizin-4-one
CID 21364101
7-Isocyano-2-methylquinolizin-4-one
CID 21364159
5-methyl-1-(1-methyl-2H-pyridin-4-yl)pyridin-2-one
CID 70876244
1-Methylquinolizin-4-one
CID 87486754
1H-indolizino[1,2-b]quinolin-9-one
CID 87652005
9-Methylquinolizin-4-one
CID 122207330
1,6-Dimethyl-5-(methyliminomethyl)pyridin-2-one
CID 123207508
1-Isocyano-2-methylquinolizin-4-one
CID 140746703
2,8-Dimethylquinolizin-4-one
CID 155248244
8-(Dimethylamino)-2-methylquinolizin-4-one
CID 155248497
1-[(5-methyl-4H-pyridin-4-id-2-yl)methyl]pyridin-2-one;yttrium
CID 172336548
5-(1-Methyl-2-pyridinylidene)pyridin-2-one
CID 173501836

Frequently Asked Questions

What is the IUPAC name of ethane;1-methyl-5H-1,6-naphthyridin-5-id-2-one;ruthenium(1+)?
The IUPAC name of ethane;1-methyl-5H-1,6-naphthyridin-5-id-2-one;ruthenium(1+) (CID 170592021) is ethane;1-methyl-5H-1,6-naphthyridin-5-id-2-one;ruthenium(1+).
What is the SMILES notation for ethane;1-methyl-5H-1,6-naphthyridin-5-id-2-one;ruthenium(1+)?
The canonical SMILES for ethane;1-methyl-5H-1,6-naphthyridin-5-id-2-one;ruthenium(1+) is CC.Cn1c(=O)ccc2[c-]nccc21.[Ru+].
What is the InChIKey of ethane;1-methyl-5H-1,6-naphthyridin-5-id-2-one;ruthenium(1+)?
The InChIKey is KSMHKDHGUMSWFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7N2O.C2H6.Ru/c1-11-8-4-5-10-6-7(8)2-3-9(11)12;1-2;/h2-5H,1H3;1-2H3;/q-1;;+1.
What are the key properties of ethane;1-methyl-5H-1,6-naphthyridin-5-id-2-one;ruthenium(1+)?
ethane;1-methyl-5H-1,6-naphthyridin-5-id-2-one;ruthenium(1+) has a molecular weight of 290.31 g/mol, XLogP of 1.76, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;1-methyl-5H-1,6-naphthyridin-5-id-2-one;ruthenium(1+) is sourced from PubChem (CID 170592021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).