3-(naphthalen-2-ylmethoxy)-1H-indazole

C18H14N2O — CID 152763229

IUPAC3-(naphthalen-2-ylmethoxy)-1H-indazole
SMILESc1ccc2cc(COc3n[nH]c4ccccc34)ccc2c1
InChIInChI=1S/C18H14N2O/c1-2-6-15-11-13(9-10-14(15)5-1)12-21-18-16-7-3-4-8-17(16)19-20-18/h1-11H,12H2,(H,19,20)
InChIKeyLMCOXFRMYOOHTQ-UHFFFAOYSA-N
MW274.32 g/mol
LogP4.30
Rot. Bonds3

About 3-(naphthalen-2-ylmethoxy)-1H-indazole

3-(naphthalen-2-ylmethoxy)-1H-indazole (PubChem CID 152763229) has the molecular formula C18H14N2O and a molecular weight of 274.32 g/mol. Its IUPAC name is 3-(naphthalen-2-ylmethoxy)-1H-indazole.

Molecular Properties

Compound Name3-(naphthalen-2-ylmethoxy)-1H-indazole
PubChem CID152763229
Molecular FormulaC18H14N2O
Molecular Weight274.32 g/mol
Exact Mass274.11
IUPAC Name3-(naphthalen-2-ylmethoxy)-1H-indazole
SMILESc1ccc2cc(COc3n[nH]c4ccccc34)ccc2c1
InChIInChI=1S/C18H14N2O/c1-2-6-15-11-13(9-10-14(15)5-1)12-21-18-16-7-3-4-8-17(16)19-20-18/h1-11H,12H2,(H,19,20)
InChIKeyLMCOXFRMYOOHTQ-UHFFFAOYSA-N
XLogP4.30
TPSA37.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 54.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Mps1 Inhibitor I
CID 73345836
3,5-bis(4-propan-2-yloxyphenyl)-1H-indazole
CID 134179643
3-(naphthalen-1-ylmethoxy)-5-nitro-1H-indazole
CID 141700628
1-(2-Cyclohexylethyl)-3-(naphthalen-2-ylmethoxy)indazole
CID 141700633
3-(naphthalen-1-ylmethoxy)-1H-indazole
CID 154487473
1-Methyl-3-(naphthalen-2-ylmethoxy)indazole
CID 51356766
3-(naphthalen-2-ylmethoxy)-5-nitro-1H-indazole
CID 152763228
3-[(4-methoxyphenyl)methoxy]-1H-indazole
CID 154487474
1-Propanamine, 3-(1H-indazol-3-yloxy)-N,N-dimethyl-
CID 10220074
3-[[3-[(E)-2-phenylethenyl]-1H-indazol-6-yl]oxy]aniline
CID 21877575
3-(E-styryl)-6-phenoxy-1H-indazole
CID 21877604
4-(3-methoxy-1H-indazol-5-yl)-2,6-dimethyl-3,4-dihydropyridine-3,5-dicarbonitrile
CID 90949339

Frequently Asked Questions

What is the IUPAC name of 3-(naphthalen-2-ylmethoxy)-1H-indazole?
The IUPAC name of 3-(naphthalen-2-ylmethoxy)-1H-indazole (CID 152763229) is 3-(naphthalen-2-ylmethoxy)-1H-indazole.
What is the SMILES notation for 3-(naphthalen-2-ylmethoxy)-1H-indazole?
The canonical SMILES for 3-(naphthalen-2-ylmethoxy)-1H-indazole is c1ccc2cc(COc3n[nH]c4ccccc34)ccc2c1.
What is the InChIKey of 3-(naphthalen-2-ylmethoxy)-1H-indazole?
The InChIKey is LMCOXFRMYOOHTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14N2O/c1-2-6-15-11-13(9-10-14(15)5-1)12-21-18-16-7-3-4-8-17(16)19-20-18/h1-11H,12H2,(H,19,20).
What are the key properties of 3-(naphthalen-2-ylmethoxy)-1H-indazole?
3-(naphthalen-2-ylmethoxy)-1H-indazole has a molecular weight of 274.32 g/mol, XLogP of 4.30, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(naphthalen-2-ylmethoxy)-1H-indazole is sourced from PubChem (CID 152763229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).