2-[4-(2-piperidin-1-ylethylcarbamoyl)phenyl]indazole-7-carboxamide

C22H25N5O2 — CID 46226266

IUPAC2-[4-(2-piperidin-1-ylethylcarbamoyl)phenyl]indazole-7-carboxamide
SMILESNC(=O)c1cccc2cn(-c3ccc(C(=O)NCCN4CCCCC4)cc3)nc12
InChIInChI=1S/C22H25N5O2/c23-21(28)19-6-4-5-17-15-27(25-20(17)19)18-9-7-16(8-10-18)22(29)24-11-14-26-12-2-1-3-13-26/h4-10,15H,1-3,11-14H2,(H2,23,28)(H,24,29)
InChIKeyULVFRRVSDXFDPR-UHFFFAOYSA-N
MW391.48 g/mol
LogP2.34
Rot. Bonds6

About 2-[4-(2-piperidin-1-ylethylcarbamoyl)phenyl]indazole-7-carboxamide

2-[4-(2-piperidin-1-ylethylcarbamoyl)phenyl]indazole-7-carboxamide (PubChem CID 46226266) has the molecular formula C22H25N5O2 and a molecular weight of 391.48 g/mol. Its IUPAC name is 2-[4-(2-piperidin-1-ylethylcarbamoyl)phenyl]indazole-7-carboxamide.

Molecular Properties

Compound Name2-[4-(2-piperidin-1-ylethylcarbamoyl)phenyl]indazole-7-carboxamide
PubChem CID46226266
Molecular FormulaC22H25N5O2
Molecular Weight391.48 g/mol
Exact Mass391.20
IUPAC Name2-[4-(2-piperidin-1-ylethylcarbamoyl)phenyl]indazole-7-carboxamide
SMILESNC(=O)c1cccc2cn(-c3ccc(C(=O)NCCN4CCCCC4)cc3)nc12
InChIInChI=1S/C22H25N5O2/c23-21(28)19-6-4-5-17-15-27(25-20(17)19)18-9-7-16(8-10-18)22(29)24-11-14-26-12-2-1-3-13-26/h4-10,15H,1-3,11-14H2,(H2,23,28)(H,24,29)
InChIKeyULVFRRVSDXFDPR-UHFFFAOYSA-N
XLogP2.34
TPSA93.25 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.48
LogP ≤ 52.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[4-(2-piperidin-1-ylethylcarbamoyl)phenyl]indazole-7-carboxamide?
The IUPAC name of 2-[4-(2-piperidin-1-ylethylcarbamoyl)phenyl]indazole-7-carboxamide (CID 46226266) is 2-[4-(2-piperidin-1-ylethylcarbamoyl)phenyl]indazole-7-carboxamide.
What is the SMILES notation for 2-[4-(2-piperidin-1-ylethylcarbamoyl)phenyl]indazole-7-carboxamide?
The canonical SMILES for 2-[4-(2-piperidin-1-ylethylcarbamoyl)phenyl]indazole-7-carboxamide is NC(=O)c1cccc2cn(-c3ccc(C(=O)NCCN4CCCCC4)cc3)nc12.
What is the InChIKey of 2-[4-(2-piperidin-1-ylethylcarbamoyl)phenyl]indazole-7-carboxamide?
The InChIKey is ULVFRRVSDXFDPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25N5O2/c23-21(28)19-6-4-5-17-15-27(25-20(17)19)18-9-7-16(8-10-18)22(29)24-11-14-26-12-2-1-3-13-26/h4-10,15H,1-3,11-14H2,(H2,23,28)(H,24,29).
What are the key properties of 2-[4-(2-piperidin-1-ylethylcarbamoyl)phenyl]indazole-7-carboxamide?
2-[4-(2-piperidin-1-ylethylcarbamoyl)phenyl]indazole-7-carboxamide has a molecular weight of 391.48 g/mol, XLogP of 2.34, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2-piperidin-1-ylethylcarbamoyl)phenyl]indazole-7-carboxamide is sourced from PubChem (CID 46226266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).