2-[4-(1-oxa-9-azaspiro[4.5]decan-9-ylmethyl)phenyl]indazole-7-carboxamide

C23H26N4O2 — CID 87362276

IUPAC2-[4-(1-oxa-9-azaspiro[4.5]decan-9-ylmethyl)phenyl]indazole-7-carboxamide
SMILESNC(=O)c1cccc2cn(-c3ccc(CN4CCCC5(CCCO5)C4)cc3)nc12
InChIInChI=1S/C23H26N4O2/c24-22(28)20-5-1-4-18-15-27(25-21(18)20)19-8-6-17(7-9-19)14-26-12-2-10-23(16-26)11-3-13-29-23/h1,4-9,15H,2-3,10-14,16H2,(H2,24,28)
InChIKeyQHVXHONAOSKODI-UHFFFAOYSA-N
MW390.49 g/mol
LogP3.27
Rot. Bonds4

About 2-[4-(1-oxa-9-azaspiro[4.5]decan-9-ylmethyl)phenyl]indazole-7-carboxamide

2-[4-(1-oxa-9-azaspiro[4.5]decan-9-ylmethyl)phenyl]indazole-7-carboxamide (PubChem CID 87362276) has the molecular formula C23H26N4O2 and a molecular weight of 390.49 g/mol. Its IUPAC name is 2-[4-(1-oxa-9-azaspiro[4.5]decan-9-ylmethyl)phenyl]indazole-7-carboxamide.

Molecular Properties

Compound Name2-[4-(1-oxa-9-azaspiro[4.5]decan-9-ylmethyl)phenyl]indazole-7-carboxamide
PubChem CID87362276
Molecular FormulaC23H26N4O2
Molecular Weight390.49 g/mol
Exact Mass390.21
IUPAC Name2-[4-(1-oxa-9-azaspiro[4.5]decan-9-ylmethyl)phenyl]indazole-7-carboxamide
SMILESNC(=O)c1cccc2cn(-c3ccc(CN4CCCC5(CCCO5)C4)cc3)nc12
InChIInChI=1S/C23H26N4O2/c24-22(28)20-5-1-4-18-15-27(25-21(18)20)19-8-6-17(7-9-19)14-26-12-2-10-23(16-26)11-3-13-29-23/h1,4-9,15H,2-3,10-14,16H2,(H2,24,28)
InChIKeyQHVXHONAOSKODI-UHFFFAOYSA-N
XLogP3.27
TPSA73.38 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.49
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-[4-(1-oxa-9-azaspiro[4.5]decan-9-ylmethyl)phenyl]indazole-7-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[4-(1-oxa-9-azaspiro[4.5]decan-9-ylmethyl)phenyl]indazole-7-carboxamide?
The IUPAC name of 2-[4-(1-oxa-9-azaspiro[4.5]decan-9-ylmethyl)phenyl]indazole-7-carboxamide (CID 87362276) is 2-[4-(1-oxa-9-azaspiro[4.5]decan-9-ylmethyl)phenyl]indazole-7-carboxamide.
What is the SMILES notation for 2-[4-(1-oxa-9-azaspiro[4.5]decan-9-ylmethyl)phenyl]indazole-7-carboxamide?
The canonical SMILES for 2-[4-(1-oxa-9-azaspiro[4.5]decan-9-ylmethyl)phenyl]indazole-7-carboxamide is NC(=O)c1cccc2cn(-c3ccc(CN4CCCC5(CCCO5)C4)cc3)nc12.
What is the InChIKey of 2-[4-(1-oxa-9-azaspiro[4.5]decan-9-ylmethyl)phenyl]indazole-7-carboxamide?
The InChIKey is QHVXHONAOSKODI-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N4O2/c24-22(28)20-5-1-4-18-15-27(25-21(18)20)19-8-6-17(7-9-19)14-26-12-2-10-23(16-26)11-3-13-29-23/h1,4-9,15H,2-3,10-14,16H2,(H2,24,28).
What are the key properties of 2-[4-(1-oxa-9-azaspiro[4.5]decan-9-ylmethyl)phenyl]indazole-7-carboxamide?
2-[4-(1-oxa-9-azaspiro[4.5]decan-9-ylmethyl)phenyl]indazole-7-carboxamide has a molecular weight of 390.49 g/mol, XLogP of 3.27, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(1-oxa-9-azaspiro[4.5]decan-9-ylmethyl)phenyl]indazole-7-carboxamide is sourced from PubChem (CID 87362276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).