3-(6-methoxynaphthalen-2-yl)-1H-indazole-5-carboxamide

C19H15N3O2 — CID 22480121

IUPAC3-(6-methoxynaphthalen-2-yl)-1H-indazole-5-carboxamide
SMILESCOc1ccc2cc(-c3n[nH]c4ccc(C(N)=O)cc34)ccc2c1
InChIInChI=1S/C19H15N3O2/c1-24-15-6-4-11-8-13(3-2-12(11)9-15)18-16-10-14(19(20)23)5-7-17(16)21-22-18/h2-10H,1H3,(H2,20,23)(H,21,22)
InChIKeyBLWTVYBQDIFPOQ-UHFFFAOYSA-N
MW317.35 g/mol
LogP3.49
Rot. Bonds3

About 3-(6-methoxynaphthalen-2-yl)-1H-indazole-5-carboxamide

3-(6-methoxynaphthalen-2-yl)-1H-indazole-5-carboxamide (PubChem CID 22480121) has the molecular formula C19H15N3O2 and a molecular weight of 317.35 g/mol. Its IUPAC name is 3-(6-methoxynaphthalen-2-yl)-1H-indazole-5-carboxamide.

Molecular Properties

Compound Name3-(6-methoxynaphthalen-2-yl)-1H-indazole-5-carboxamide
PubChem CID22480121
Molecular FormulaC19H15N3O2
Molecular Weight317.35 g/mol
Exact Mass317.12
IUPAC Name3-(6-methoxynaphthalen-2-yl)-1H-indazole-5-carboxamide
SMILESCOc1ccc2cc(-c3n[nH]c4ccc(C(N)=O)cc34)ccc2c1
InChIInChI=1S/C19H15N3O2/c1-24-15-6-4-11-8-13(3-2-12(11)9-15)18-16-10-14(19(20)23)5-7-17(16)21-22-18/h2-10H,1H3,(H2,20,23)(H,21,22)
InChIKeyBLWTVYBQDIFPOQ-UHFFFAOYSA-N
XLogP3.49
TPSA81.00 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.35
LogP ≤ 53.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(6-methoxynaphthalen-2-yl)-1H-indazole-5-carboxamide?
The IUPAC name of 3-(6-methoxynaphthalen-2-yl)-1H-indazole-5-carboxamide (CID 22480121) is 3-(6-methoxynaphthalen-2-yl)-1H-indazole-5-carboxamide.
What is the SMILES notation for 3-(6-methoxynaphthalen-2-yl)-1H-indazole-5-carboxamide?
The canonical SMILES for 3-(6-methoxynaphthalen-2-yl)-1H-indazole-5-carboxamide is COc1ccc2cc(-c3n[nH]c4ccc(C(N)=O)cc34)ccc2c1.
What is the InChIKey of 3-(6-methoxynaphthalen-2-yl)-1H-indazole-5-carboxamide?
The InChIKey is BLWTVYBQDIFPOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15N3O2/c1-24-15-6-4-11-8-13(3-2-12(11)9-15)18-16-10-14(19(20)23)5-7-17(16)21-22-18/h2-10H,1H3,(H2,20,23)(H,21,22).
What are the key properties of 3-(6-methoxynaphthalen-2-yl)-1H-indazole-5-carboxamide?
3-(6-methoxynaphthalen-2-yl)-1H-indazole-5-carboxamide has a molecular weight of 317.35 g/mol, XLogP of 3.49, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(6-methoxynaphthalen-2-yl)-1H-indazole-5-carboxamide is sourced from PubChem (CID 22480121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).