2-benzylindazole-7-carboxamide

C15H13N3O — CID 44549372

IUPAC2-benzylindazole-7-carboxamide
SMILESNC(=O)c1cccc2cn(Cc3ccccc3)nc12
InChIInChI=1S/C15H13N3O/c16-15(19)13-8-4-7-12-10-18(17-14(12)13)9-11-5-2-1-3-6-11/h1-8,10H,9H2,(H2,16,19)
InChIKeyFCHCPSCDAOGWGQ-UHFFFAOYSA-N
MW251.29 g/mol
LogP2.18
Rot. Bonds3

About 2-benzylindazole-7-carboxamide

2-benzylindazole-7-carboxamide (PubChem CID 44549372) has the molecular formula C15H13N3O and a molecular weight of 251.29 g/mol. Its IUPAC name is 2-benzylindazole-7-carboxamide.

Molecular Properties

Compound Name2-benzylindazole-7-carboxamide
PubChem CID44549372
Molecular FormulaC15H13N3O
Molecular Weight251.29 g/mol
Exact Mass251.11
IUPAC Name2-benzylindazole-7-carboxamide
SMILESNC(=O)c1cccc2cn(Cc3ccccc3)nc12
InChIInChI=1S/C15H13N3O/c16-15(19)13-8-4-7-12-10-18(17-14(12)13)9-11-5-2-1-3-6-11/h1-8,10H,9H2,(H2,16,19)
InChIKeyFCHCPSCDAOGWGQ-UHFFFAOYSA-N
XLogP2.18
TPSA60.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.29
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-benzylindazole-7-carboxamide?
The IUPAC name of 2-benzylindazole-7-carboxamide (CID 44549372) is 2-benzylindazole-7-carboxamide.
What is the SMILES notation for 2-benzylindazole-7-carboxamide?
The canonical SMILES for 2-benzylindazole-7-carboxamide is NC(=O)c1cccc2cn(Cc3ccccc3)nc12.
What is the InChIKey of 2-benzylindazole-7-carboxamide?
The InChIKey is FCHCPSCDAOGWGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3O/c16-15(19)13-8-4-7-12-10-18(17-14(12)13)9-11-5-2-1-3-6-11/h1-8,10H,9H2,(H2,16,19).
What are the key properties of 2-benzylindazole-7-carboxamide?
2-benzylindazole-7-carboxamide has a molecular weight of 251.29 g/mol, XLogP of 2.18, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-benzylindazole-7-carboxamide is sourced from PubChem (CID 44549372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).