8-bromo-2-ethoxy-6-(2-methylindazol-5-yl)-1,6-naphthyridin-7-one

C18H15BrN4O2 — CID 139536281

IUPAC8-bromo-2-ethoxy-6-(2-methylindazol-5-yl)-1,6-naphthyridin-7-one
SMILESCCOc1ccc2cn(-c3ccc4nn(C)cc4c3)c(=O)c(Br)c2n1
InChIInChI=1S/C18H15BrN4O2/c1-3-25-15-7-4-11-10-23(18(24)16(19)17(11)20-15)13-5-6-14-12(8-13)9-22(2)21-14/h4-10H,3H2,1-2H3
InChIKeyDXVSUTFWMFWLDE-UHFFFAOYSA-N
MW399.25 g/mol
LogP3.43
Rot. Bonds3

About 8-bromo-2-ethoxy-6-(2-methylindazol-5-yl)-1,6-naphthyridin-7-one

8-bromo-2-ethoxy-6-(2-methylindazol-5-yl)-1,6-naphthyridin-7-one (PubChem CID 139536281) has the molecular formula C18H15BrN4O2 and a molecular weight of 399.25 g/mol. Its IUPAC name is 8-bromo-2-ethoxy-6-(2-methylindazol-5-yl)-1,6-naphthyridin-7-one.

Molecular Properties

Compound Name8-bromo-2-ethoxy-6-(2-methylindazol-5-yl)-1,6-naphthyridin-7-one
PubChem CID139536281
Molecular FormulaC18H15BrN4O2
Molecular Weight399.25 g/mol
Exact Mass398.04
IUPAC Name8-bromo-2-ethoxy-6-(2-methylindazol-5-yl)-1,6-naphthyridin-7-one
SMILESCCOc1ccc2cn(-c3ccc4nn(C)cc4c3)c(=O)c(Br)c2n1
InChIInChI=1S/C18H15BrN4O2/c1-3-25-15-7-4-11-10-23(18(24)16(19)17(11)20-15)13-5-6-14-12(8-13)9-22(2)21-14/h4-10H,3H2,1-2H3
InChIKeyDXVSUTFWMFWLDE-UHFFFAOYSA-N
XLogP3.43
TPSA61.94 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500399.25
LogP ≤ 53.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

8-(4-chlorophenyl)-2-cyclopropyloxy-6-(2-methylindazol-5-yl)-1,6-naphthyridin-7-one
CID 139551966
7-ethoxy-3-(2-methylindazol-5-yl)-1-(4-methylphenyl)-1,8-naphthyridin-2-one
CID 164841224
1-(1,3-benzothiazol-5-yl)-7-ethoxy-3-(2-methylindazol-5-yl)-1,8-naphthyridin-2-one
CID 155347907
7-ethoxy-3-(2-methylindazol-5-yl)-1-[6-(trifluoromethyl)-3-pyridinyl]-1,8-naphthyridin-2-one
CID 155343700
7-ethoxy-1-[6-(ethylamino)-3-pyridinyl]-3-(2-methylindazol-5-yl)-1,8-naphthyridin-2-one
CID 155347900
6-[4-amino-3-(methyliminomethyl)phenyl]-2-ethoxy-8-[4-[(Z)-1-(ethylideneamino)but-1-enyl]phenyl]-1,6-naphthyridin-7-one
CID 139552608
6-(2,2-difluoroethoxy)-2-(2-methylindazol-5-yl)-4-phenylpyrido[3,2-c]pyridazin-3-one;6-(2,2-difluoroethoxy)-2-(2-methylindazol-5-yl)-4-pyridin-4-ylpyrido[3,2-c]pyridazin-3-one;4-[4-(difluoromethoxy)phenyl]-6-ethoxy-2-(4-methylphenyl)pyrido[3,2-c]pyridazin-3-one;6-ethoxy-2-(4-methylphenyl)-4-[6-(trifluoromethoxy)-3-pyridinyl]pyrido[3,2-c]pyridazin-3-one
CID 164956656
ethyl 2-(2-methylindazol-5-yl)acetate
CID 155343728
4-chloro-5-[(2,2-difluorocyclopropyl)methyl]-7-iodo-2-(2-methylindazol-5-yl)pyrrolo[3,2-c]pyridazin-3-one
CID 163385416
3-(2-methylindazol-5-yl)-7-piperidin-4-ylquinazolin-4-one
CID 156889049
2,5-dimethylindazole
CID 58763639
1-(2-methylindazol-5-yl)-4-(sulfanylmethyl)pyrrolidin-2-one
CID 168670795

Frequently Asked Questions

What is the IUPAC name of 8-bromo-2-ethoxy-6-(2-methylindazol-5-yl)-1,6-naphthyridin-7-one?
The IUPAC name of 8-bromo-2-ethoxy-6-(2-methylindazol-5-yl)-1,6-naphthyridin-7-one (CID 139536281) is 8-bromo-2-ethoxy-6-(2-methylindazol-5-yl)-1,6-naphthyridin-7-one.
What is the SMILES notation for 8-bromo-2-ethoxy-6-(2-methylindazol-5-yl)-1,6-naphthyridin-7-one?
The canonical SMILES for 8-bromo-2-ethoxy-6-(2-methylindazol-5-yl)-1,6-naphthyridin-7-one is CCOc1ccc2cn(-c3ccc4nn(C)cc4c3)c(=O)c(Br)c2n1.
What is the InChIKey of 8-bromo-2-ethoxy-6-(2-methylindazol-5-yl)-1,6-naphthyridin-7-one?
The InChIKey is DXVSUTFWMFWLDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15BrN4O2/c1-3-25-15-7-4-11-10-23(18(24)16(19)17(11)20-15)13-5-6-14-12(8-13)9-22(2)21-14/h4-10H,3H2,1-2H3.
What are the key properties of 8-bromo-2-ethoxy-6-(2-methylindazol-5-yl)-1,6-naphthyridin-7-one?
8-bromo-2-ethoxy-6-(2-methylindazol-5-yl)-1,6-naphthyridin-7-one has a molecular weight of 399.25 g/mol, XLogP of 3.43, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 8-bromo-2-ethoxy-6-(2-methylindazol-5-yl)-1,6-naphthyridin-7-one is sourced from PubChem (CID 139536281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).