7-methoxy-N-(2-methylpropyl)-1-[3-(4-oxospiro[3H-chromene-2,4'-piperidine]-1'-yl)propyl]indole-3-carboxamide

C30H37N3O4 — CID 58968387

IUPAC7-methoxy-N-(2-methylpropyl)-1-[3-(4-oxospiro[3H-chromene-2,4'-piperidine]-1'-yl)propyl]indole-3-carboxamide
SMILESCOc1cccc2c(C(=O)NCC(C)C)cn(CCCN3CCC4(CC3)CC(=O)c3ccccc3O4)c12
InChIInChI=1S/C30H37N3O4/c1-21(2)19-31-29(35)24-20-33(28-22(24)9-6-11-27(28)36-3)15-7-14-32-16-12-30(13-17-32)18-25(34)23-8-4-5-10-26(23)37-30/h4-6,8-11,20-21H,7,12-19H2,1-3H3,(H,31,35)
InChIKeyQYPCVKYAXSNPDG-UHFFFAOYSA-N
MW503.64 g/mol
LogP4.93
Rot. Bonds8

About 7-methoxy-N-(2-methylpropyl)-1-[3-(4-oxospiro[3H-chromene-2,4'-piperidine]-1'-yl)propyl]indole-3-carboxamide

7-methoxy-N-(2-methylpropyl)-1-[3-(4-oxospiro[3H-chromene-2,4'-piperidine]-1'-yl)propyl]indole-3-carboxamide (PubChem CID 58968387) has the molecular formula C30H37N3O4 and a molecular weight of 503.64 g/mol. Its IUPAC name is 7-methoxy-N-(2-methylpropyl)-1-[3-(4-oxospiro[3H-chromene-2,4'-piperidine]-1'-yl)propyl]indole-3-carboxamide.

Molecular Properties

Compound Name7-methoxy-N-(2-methylpropyl)-1-[3-(4-oxospiro[3H-chromene-2,4'-piperidine]-1'-yl)propyl]indole-3-carboxamide
PubChem CID58968387
Molecular FormulaC30H37N3O4
Molecular Weight503.64 g/mol
Exact Mass503.28
IUPAC Name7-methoxy-N-(2-methylpropyl)-1-[3-(4-oxospiro[3H-chromene-2,4'-piperidine]-1'-yl)propyl]indole-3-carboxamide
SMILESCOc1cccc2c(C(=O)NCC(C)C)cn(CCCN3CCC4(CC3)CC(=O)c3ccccc3O4)c12
InChIInChI=1S/C30H37N3O4/c1-21(2)19-31-29(35)24-20-33(28-22(24)9-6-11-27(28)36-3)15-7-14-32-16-12-30(13-17-32)18-25(34)23-8-4-5-10-26(23)37-30/h4-6,8-11,20-21H,7,12-19H2,1-3H3,(H,31,35)
InChIKeyQYPCVKYAXSNPDG-UHFFFAOYSA-N
XLogP4.93
TPSA72.80 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms37
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500503.64
LogP ≤ 54.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 7-methoxy-N-(2-methylpropyl)-1-[3-(4-oxospiro[3H-chromene-2,4'-piperidine]-1'-yl)propyl]indole-3-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 7-methoxy-N-(2-methylpropyl)-1-[3-(4-oxospiro[3H-chromene-2,4'-piperidine]-1'-yl)propyl]indole-3-carboxamide?
The IUPAC name of 7-methoxy-N-(2-methylpropyl)-1-[3-(4-oxospiro[3H-chromene-2,4'-piperidine]-1'-yl)propyl]indole-3-carboxamide (CID 58968387) is 7-methoxy-N-(2-methylpropyl)-1-[3-(4-oxospiro[3H-chromene-2,4'-piperidine]-1'-yl)propyl]indole-3-carboxamide.
What is the SMILES notation for 7-methoxy-N-(2-methylpropyl)-1-[3-(4-oxospiro[3H-chromene-2,4'-piperidine]-1'-yl)propyl]indole-3-carboxamide?
The canonical SMILES for 7-methoxy-N-(2-methylpropyl)-1-[3-(4-oxospiro[3H-chromene-2,4'-piperidine]-1'-yl)propyl]indole-3-carboxamide is COc1cccc2c(C(=O)NCC(C)C)cn(CCCN3CCC4(CC3)CC(=O)c3ccccc3O4)c12.
What is the InChIKey of 7-methoxy-N-(2-methylpropyl)-1-[3-(4-oxospiro[3H-chromene-2,4'-piperidine]-1'-yl)propyl]indole-3-carboxamide?
The InChIKey is QYPCVKYAXSNPDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H37N3O4/c1-21(2)19-31-29(35)24-20-33(28-22(24)9-6-11-27(28)36-3)15-7-14-32-16-12-30(13-17-32)18-25(34)23-8-4-5-10-26(23)37-30/h4-6,8-11,20-21H,7,12-19H2,1-3H3,(H,31,35).
What are the key properties of 7-methoxy-N-(2-methylpropyl)-1-[3-(4-oxospiro[3H-chromene-2,4'-piperidine]-1'-yl)propyl]indole-3-carboxamide?
7-methoxy-N-(2-methylpropyl)-1-[3-(4-oxospiro[3H-chromene-2,4'-piperidine]-1'-yl)propyl]indole-3-carboxamide has a molecular weight of 503.64 g/mol, XLogP of 4.93, 8 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-N-(2-methylpropyl)-1-[3-(4-oxospiro[3H-chromene-2,4'-piperidine]-1'-yl)propyl]indole-3-carboxamide is sourced from PubChem (CID 58968387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).