dichlorocopper;7-methyl-1H-1,8-naphthyridin-4-one

C9H8Cl2CuN2O — CID 70610790

IUPACdichlorocopper;7-methyl-1H-1,8-naphthyridin-4-one
SMILESCc1ccc2c(=O)cc[nH]c2n1.Cl[Cu]Cl
InChIInChI=1S/C9H8N2O.2ClH.Cu/c1-6-2-3-7-8(12)4-5-10-9(7)11-6;;;/h2-5H,1H3,(H,10,11,12);2*1H;/q;;;+2/p-2
InChIKeyAJXKDZGNBSUOLR-UHFFFAOYSA-L
MW294.63 g/mol
LogP2.61
Rot. Bonds

About dichlorocopper;7-methyl-1H-1,8-naphthyridin-4-one

dichlorocopper;7-methyl-1H-1,8-naphthyridin-4-one (PubChem CID 70610790) has the molecular formula C9H8Cl2CuN2O and a molecular weight of 294.63 g/mol. Its IUPAC name is dichlorocopper;7-methyl-1H-1,8-naphthyridin-4-one.

Molecular Properties

Compound Namedichlorocopper;7-methyl-1H-1,8-naphthyridin-4-one
PubChem CID70610790
Molecular FormulaC9H8Cl2CuN2O
Molecular Weight294.63 g/mol
Exact Mass292.93
IUPAC Namedichlorocopper;7-methyl-1H-1,8-naphthyridin-4-one
SMILESCc1ccc2c(=O)cc[nH]c2n1.Cl[Cu]Cl
InChIInChI=1S/C9H8N2O.2ClH.Cu/c1-6-2-3-7-8(12)4-5-10-9(7)11-6;;;/h2-5H,1H3,(H,10,11,12);2*1H;/q;;;+2/p-2
InChIKeyAJXKDZGNBSUOLR-UHFFFAOYSA-L
XLogP2.61
TPSA45.75 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.63
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of dichlorocopper;7-methyl-1H-1,8-naphthyridin-4-one?
The IUPAC name of dichlorocopper;7-methyl-1H-1,8-naphthyridin-4-one (CID 70610790) is dichlorocopper;7-methyl-1H-1,8-naphthyridin-4-one.
What is the SMILES notation for dichlorocopper;7-methyl-1H-1,8-naphthyridin-4-one?
The canonical SMILES for dichlorocopper;7-methyl-1H-1,8-naphthyridin-4-one is Cc1ccc2c(=O)cc[nH]c2n1.Cl[Cu]Cl.
What is the InChIKey of dichlorocopper;7-methyl-1H-1,8-naphthyridin-4-one?
The InChIKey is AJXKDZGNBSUOLR-UHFFFAOYSA-L. The full InChI is InChI=1S/C9H8N2O.2ClH.Cu/c1-6-2-3-7-8(12)4-5-10-9(7)11-6;;;/h2-5H,1H3,(H,10,11,12);2*1H;/q;;;+2/p-2.
What are the key properties of dichlorocopper;7-methyl-1H-1,8-naphthyridin-4-one?
dichlorocopper;7-methyl-1H-1,8-naphthyridin-4-one has a molecular weight of 294.63 g/mol, XLogP of 2.61, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for dichlorocopper;7-methyl-1H-1,8-naphthyridin-4-one is sourced from PubChem (CID 70610790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).