3-naphthalen-2-yl-1H-indazole-5-carboxamide

C18H13N3O — CID 22480177

IUPAC3-naphthalen-2-yl-1H-indazole-5-carboxamide
SMILESNC(=O)c1ccc2[nH]nc(-c3ccc4ccccc4c3)c2c1
InChIInChI=1S/C18H13N3O/c19-18(22)14-7-8-16-15(10-14)17(21-20-16)13-6-5-11-3-1-2-4-12(11)9-13/h1-10H,(H2,19,22)(H,20,21)
InChIKeyXFHQIAFMNXNSMN-UHFFFAOYSA-N
MW287.32 g/mol
LogP3.48
Rot. Bonds2

About 3-naphthalen-2-yl-1H-indazole-5-carboxamide

3-naphthalen-2-yl-1H-indazole-5-carboxamide (PubChem CID 22480177) has the molecular formula C18H13N3O and a molecular weight of 287.32 g/mol. Its IUPAC name is 3-naphthalen-2-yl-1H-indazole-5-carboxamide.

Molecular Properties

Compound Name3-naphthalen-2-yl-1H-indazole-5-carboxamide
PubChem CID22480177
Molecular FormulaC18H13N3O
Molecular Weight287.32 g/mol
Exact Mass287.11
IUPAC Name3-naphthalen-2-yl-1H-indazole-5-carboxamide
SMILESNC(=O)c1ccc2[nH]nc(-c3ccc4ccccc4c3)c2c1
InChIInChI=1S/C18H13N3O/c19-18(22)14-7-8-16-15(10-14)17(21-20-16)13-6-5-11-3-1-2-4-12(11)9-13/h1-10H,(H2,19,22)(H,20,21)
InChIKeyXFHQIAFMNXNSMN-UHFFFAOYSA-N
XLogP3.48
TPSA71.77 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.32
LogP ≤ 53.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-naphthalen-2-yl-1H-indazole-5-carboxamide?
The IUPAC name of 3-naphthalen-2-yl-1H-indazole-5-carboxamide (CID 22480177) is 3-naphthalen-2-yl-1H-indazole-5-carboxamide.
What is the SMILES notation for 3-naphthalen-2-yl-1H-indazole-5-carboxamide?
The canonical SMILES for 3-naphthalen-2-yl-1H-indazole-5-carboxamide is NC(=O)c1ccc2[nH]nc(-c3ccc4ccccc4c3)c2c1.
What is the InChIKey of 3-naphthalen-2-yl-1H-indazole-5-carboxamide?
The InChIKey is XFHQIAFMNXNSMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13N3O/c19-18(22)14-7-8-16-15(10-14)17(21-20-16)13-6-5-11-3-1-2-4-12(11)9-13/h1-10H,(H2,19,22)(H,20,21).
What are the key properties of 3-naphthalen-2-yl-1H-indazole-5-carboxamide?
3-naphthalen-2-yl-1H-indazole-5-carboxamide has a molecular weight of 287.32 g/mol, XLogP of 3.48, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-naphthalen-2-yl-1H-indazole-5-carboxamide is sourced from PubChem (CID 22480177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).