2-(4-piperidin-4-ylphenyl)indazole-7-carboxamide

C19H20N4O — CID 44549379

IUPAC2-(4-piperidin-4-ylphenyl)indazole-7-carboxamide
SMILESNC(=O)c1cccc2cn(-c3ccc(C4CCNCC4)cc3)nc12
InChIInChI=1S/C19H20N4O/c20-19(24)17-3-1-2-15-12-23(22-18(15)17)16-6-4-13(5-7-16)14-8-10-21-11-9-14/h1-7,12,14,21H,8-11H2,(H2,20,24)
InChIKeyBEPRVBINFVNKHV-UHFFFAOYSA-N
MW320.40 g/mol
LogP2.59
Rot. Bonds3

About 2-(4-piperidin-4-ylphenyl)indazole-7-carboxamide

2-(4-piperidin-4-ylphenyl)indazole-7-carboxamide (PubChem CID 44549379) has the molecular formula C19H20N4O and a molecular weight of 320.40 g/mol. Its IUPAC name is 2-(4-piperidin-4-ylphenyl)indazole-7-carboxamide.

Molecular Properties

Compound Name2-(4-piperidin-4-ylphenyl)indazole-7-carboxamide
PubChem CID44549379
Molecular FormulaC19H20N4O
Molecular Weight320.40 g/mol
Exact Mass320.16
IUPAC Name2-(4-piperidin-4-ylphenyl)indazole-7-carboxamide
SMILESNC(=O)c1cccc2cn(-c3ccc(C4CCNCC4)cc3)nc12
InChIInChI=1S/C19H20N4O/c20-19(24)17-3-1-2-15-12-23(22-18(15)17)16-6-4-13(5-7-16)14-8-10-21-11-9-14/h1-7,12,14,21H,8-11H2,(H2,20,24)
InChIKeyBEPRVBINFVNKHV-UHFFFAOYSA-N
XLogP2.59
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.40
LogP ≤ 52.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(4-piperidin-4-ylphenyl)indazole-7-carboxamide?
The IUPAC name of 2-(4-piperidin-4-ylphenyl)indazole-7-carboxamide (CID 44549379) is 2-(4-piperidin-4-ylphenyl)indazole-7-carboxamide.
What is the SMILES notation for 2-(4-piperidin-4-ylphenyl)indazole-7-carboxamide?
The canonical SMILES for 2-(4-piperidin-4-ylphenyl)indazole-7-carboxamide is NC(=O)c1cccc2cn(-c3ccc(C4CCNCC4)cc3)nc12.
What is the InChIKey of 2-(4-piperidin-4-ylphenyl)indazole-7-carboxamide?
The InChIKey is BEPRVBINFVNKHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O/c20-19(24)17-3-1-2-15-12-23(22-18(15)17)16-6-4-13(5-7-16)14-8-10-21-11-9-14/h1-7,12,14,21H,8-11H2,(H2,20,24).
What are the key properties of 2-(4-piperidin-4-ylphenyl)indazole-7-carboxamide?
2-(4-piperidin-4-ylphenyl)indazole-7-carboxamide has a molecular weight of 320.40 g/mol, XLogP of 2.59, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-piperidin-4-ylphenyl)indazole-7-carboxamide is sourced from PubChem (CID 44549379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).