3,7-dibromo-1,5-dimethyl-1,5-naphthyridine-2,6-dione

C10H8Br2N2O2 — CID 70937303

IUPAC3,7-dibromo-1,5-dimethyl-1,5-naphthyridine-2,6-dione
SMILESCn1c(=O)c(Br)cc2c1cc(Br)c(=O)n2C
InChIInChI=1S/C10H8Br2N2O2/c1-13-7-3-6(12)10(16)14(2)8(7)4-5(11)9(13)15/h3-4H,1-2H3
InChIKeyKEXSYEACHFJUMH-UHFFFAOYSA-N
MW347.99 g/mol
LogP1.76
Rot. Bonds

About 3,7-dibromo-1,5-dimethyl-1,5-naphthyridine-2,6-dione

3,7-dibromo-1,5-dimethyl-1,5-naphthyridine-2,6-dione (PubChem CID 70937303) has the molecular formula C10H8Br2N2O2 and a molecular weight of 347.99 g/mol. Its IUPAC name is 3,7-dibromo-1,5-dimethyl-1,5-naphthyridine-2,6-dione.

Molecular Properties

Compound Name3,7-dibromo-1,5-dimethyl-1,5-naphthyridine-2,6-dione
PubChem CID70937303
Molecular FormulaC10H8Br2N2O2
Molecular Weight347.99 g/mol
Exact Mass345.90
IUPAC Name3,7-dibromo-1,5-dimethyl-1,5-naphthyridine-2,6-dione
SMILESCn1c(=O)c(Br)cc2c1cc(Br)c(=O)n2C
InChIInChI=1S/C10H8Br2N2O2/c1-13-7-3-6(12)10(16)14(2)8(7)4-5(11)9(13)15/h3-4H,1-2H3
InChIKeyKEXSYEACHFJUMH-UHFFFAOYSA-N
XLogP1.76
TPSA44.00 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.99
LogP ≤ 51.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3,7-dibromo-1,5-dimethyl-1,5-naphthyridine-2,6-dione?
The IUPAC name of 3,7-dibromo-1,5-dimethyl-1,5-naphthyridine-2,6-dione (CID 70937303) is 3,7-dibromo-1,5-dimethyl-1,5-naphthyridine-2,6-dione.
What is the SMILES notation for 3,7-dibromo-1,5-dimethyl-1,5-naphthyridine-2,6-dione?
The canonical SMILES for 3,7-dibromo-1,5-dimethyl-1,5-naphthyridine-2,6-dione is Cn1c(=O)c(Br)cc2c1cc(Br)c(=O)n2C.
What is the InChIKey of 3,7-dibromo-1,5-dimethyl-1,5-naphthyridine-2,6-dione?
The InChIKey is KEXSYEACHFJUMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8Br2N2O2/c1-13-7-3-6(12)10(16)14(2)8(7)4-5(11)9(13)15/h3-4H,1-2H3.
What are the key properties of 3,7-dibromo-1,5-dimethyl-1,5-naphthyridine-2,6-dione?
3,7-dibromo-1,5-dimethyl-1,5-naphthyridine-2,6-dione has a molecular weight of 347.99 g/mol, XLogP of 1.76, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,7-dibromo-1,5-dimethyl-1,5-naphthyridine-2,6-dione is sourced from PubChem (CID 70937303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).