1-naphthalen-2-ylindazole

C17H12N2 — CID 134338014

IUPAC1-naphthalen-2-ylindazole
SMILESc1ccc2cc(-n3ncc4ccccc43)ccc2c1
InChIInChI=1S/C17H12N2/c1-2-6-14-11-16(10-9-13(14)5-1)19-17-8-4-3-7-15(17)12-18-19/h1-12H
InChIKeyYIHJSZRWWWMGBB-UHFFFAOYSA-N
MW244.30 g/mol
LogP4.18
Rot. Bonds1

About 1-naphthalen-2-ylindazole

1-naphthalen-2-ylindazole (PubChem CID 134338014) has the molecular formula C17H12N2 and a molecular weight of 244.30 g/mol. Its IUPAC name is 1-naphthalen-2-ylindazole.

Molecular Properties

Compound Name1-naphthalen-2-ylindazole
PubChem CID134338014
Molecular FormulaC17H12N2
Molecular Weight244.30 g/mol
Exact Mass244.10
IUPAC Name1-naphthalen-2-ylindazole
SMILESc1ccc2cc(-n3ncc4ccccc43)ccc2c1
InChIInChI=1S/C17H12N2/c1-2-6-14-11-16(10-9-13(14)5-1)19-17-8-4-3-7-15(17)12-18-19/h1-12H
InChIKeyYIHJSZRWWWMGBB-UHFFFAOYSA-N
XLogP4.18
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.30
LogP ≤ 54.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 1-naphthalen-2-ylindazole?
The IUPAC name of 1-naphthalen-2-ylindazole (CID 134338014) is 1-naphthalen-2-ylindazole.
What is the SMILES notation for 1-naphthalen-2-ylindazole?
The canonical SMILES for 1-naphthalen-2-ylindazole is c1ccc2cc(-n3ncc4ccccc43)ccc2c1.
What is the InChIKey of 1-naphthalen-2-ylindazole?
The InChIKey is YIHJSZRWWWMGBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12N2/c1-2-6-14-11-16(10-9-13(14)5-1)19-17-8-4-3-7-15(17)12-18-19/h1-12H.
What are the key properties of 1-naphthalen-2-ylindazole?
1-naphthalen-2-ylindazole has a molecular weight of 244.30 g/mol, XLogP of 4.18, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-naphthalen-2-ylindazole is sourced from PubChem (CID 134338014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).