4-bromo-8-methyl-6-methylsulfanyl-1,5-naphthyridin-3-amine

C10H10BrN3S — CID 71181486

IUPAC4-bromo-8-methyl-6-methylsulfanyl-1,5-naphthyridin-3-amine
SMILESCSc1cc(C)c2ncc(N)c(Br)c2n1
InChIInChI=1S/C10H10BrN3S/c1-5-3-7(15-2)14-10-8(11)6(12)4-13-9(5)10/h3-4H,12H2,1-2H3
InChIKeyGEGJCKRPFCQIME-UHFFFAOYSA-N
MW284.18 g/mol
LogP3.00
Rot. Bonds1

About 4-bromo-8-methyl-6-methylsulfanyl-1,5-naphthyridin-3-amine

4-bromo-8-methyl-6-methylsulfanyl-1,5-naphthyridin-3-amine (PubChem CID 71181486) has the molecular formula C10H10BrN3S and a molecular weight of 284.18 g/mol. Its IUPAC name is 4-bromo-8-methyl-6-methylsulfanyl-1,5-naphthyridin-3-amine.

Molecular Properties

Compound Name4-bromo-8-methyl-6-methylsulfanyl-1,5-naphthyridin-3-amine
PubChem CID71181486
Molecular FormulaC10H10BrN3S
Molecular Weight284.18 g/mol
Exact Mass282.98
IUPAC Name4-bromo-8-methyl-6-methylsulfanyl-1,5-naphthyridin-3-amine
SMILESCSc1cc(C)c2ncc(N)c(Br)c2n1
InChIInChI=1S/C10H10BrN3S/c1-5-3-7(15-2)14-10-8(11)6(12)4-13-9(5)10/h3-4H,12H2,1-2H3
InChIKeyGEGJCKRPFCQIME-UHFFFAOYSA-N
XLogP3.00
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.18
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-bromo-8-methyl-6-methylsulfanyl-1,5-naphthyridin-3-amine?
The IUPAC name of 4-bromo-8-methyl-6-methylsulfanyl-1,5-naphthyridin-3-amine (CID 71181486) is 4-bromo-8-methyl-6-methylsulfanyl-1,5-naphthyridin-3-amine.
What is the SMILES notation for 4-bromo-8-methyl-6-methylsulfanyl-1,5-naphthyridin-3-amine?
The canonical SMILES for 4-bromo-8-methyl-6-methylsulfanyl-1,5-naphthyridin-3-amine is CSc1cc(C)c2ncc(N)c(Br)c2n1.
What is the InChIKey of 4-bromo-8-methyl-6-methylsulfanyl-1,5-naphthyridin-3-amine?
The InChIKey is GEGJCKRPFCQIME-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10BrN3S/c1-5-3-7(15-2)14-10-8(11)6(12)4-13-9(5)10/h3-4H,12H2,1-2H3.
What are the key properties of 4-bromo-8-methyl-6-methylsulfanyl-1,5-naphthyridin-3-amine?
4-bromo-8-methyl-6-methylsulfanyl-1,5-naphthyridin-3-amine has a molecular weight of 284.18 g/mol, XLogP of 3.00, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-8-methyl-6-methylsulfanyl-1,5-naphthyridin-3-amine is sourced from PubChem (CID 71181486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).