N-[[6-(1-methylsulfonylpiperidine-4-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide

C23H30N4O5S — CID 71715748

IUPACN-[[6-(1-methylsulfonylpiperidine-4-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide
SMILESCS(=O)(=O)N1CCC(C(=O)N2CCC3(CC2)CC3CNC(=O)c2cc3ccncc3o2)CC1
InChIInChI=1S/C23H30N4O5S/c1-33(30,31)27-8-3-16(4-9-27)22(29)26-10-5-23(6-11-26)13-18(23)14-25-21(28)19-12-17-2-7-24-15-20(17)32-19/h2,7,12,15-16,18H,3-6,8-11,13-14H2,1H3,(H,25,28)
InChIKeyCMBMMIPCSVGXTI-UHFFFAOYSA-N
MW474.58 g/mol
LogP1.86
Rot. Bonds5

About N-[[6-(1-methylsulfonylpiperidine-4-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide

N-[[6-(1-methylsulfonylpiperidine-4-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide (PubChem CID 71715748) has the molecular formula C23H30N4O5S and a molecular weight of 474.58 g/mol. Its IUPAC name is N-[[6-(1-methylsulfonylpiperidine-4-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[[6-(1-methylsulfonylpiperidine-4-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide
PubChem CID71715748
Molecular FormulaC23H30N4O5S
Molecular Weight474.58 g/mol
Exact Mass474.19
IUPAC NameN-[[6-(1-methylsulfonylpiperidine-4-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide
SMILESCS(=O)(=O)N1CCC(C(=O)N2CCC3(CC2)CC3CNC(=O)c2cc3ccncc3o2)CC1
InChIInChI=1S/C23H30N4O5S/c1-33(30,31)27-8-3-16(4-9-27)22(29)26-10-5-23(6-11-26)13-18(23)14-25-21(28)19-12-17-2-7-24-15-20(17)32-19/h2,7,12,15-16,18H,3-6,8-11,13-14H2,1H3,(H,25,28)
InChIKeyCMBMMIPCSVGXTI-UHFFFAOYSA-N
XLogP1.86
TPSA112.82 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500474.58
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-[[6-(1-methylsulfonylpiperidine-4-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-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 N-[[6-(1-methylsulfonylpiperidine-4-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide?
The IUPAC name of N-[[6-(1-methylsulfonylpiperidine-4-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide (CID 71715748) is N-[[6-(1-methylsulfonylpiperidine-4-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide.
What is the SMILES notation for N-[[6-(1-methylsulfonylpiperidine-4-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide?
The canonical SMILES for N-[[6-(1-methylsulfonylpiperidine-4-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide is CS(=O)(=O)N1CCC(C(=O)N2CCC3(CC2)CC3CNC(=O)c2cc3ccncc3o2)CC1.
What is the InChIKey of N-[[6-(1-methylsulfonylpiperidine-4-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide?
The InChIKey is CMBMMIPCSVGXTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H30N4O5S/c1-33(30,31)27-8-3-16(4-9-27)22(29)26-10-5-23(6-11-26)13-18(23)14-25-21(28)19-12-17-2-7-24-15-20(17)32-19/h2,7,12,15-16,18H,3-6,8-11,13-14H2,1H3,(H,25,28).
What are the key properties of N-[[6-(1-methylsulfonylpiperidine-4-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide?
N-[[6-(1-methylsulfonylpiperidine-4-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide has a molecular weight of 474.58 g/mol, XLogP of 1.86, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[6-(1-methylsulfonylpiperidine-4-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide is sourced from PubChem (CID 71715748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).