2-methyl-N-spiro[3H-furo[2,3-c]pyridine-2,4'-piperidine]-3-ylpropane-2-sulfinamide

C15H23N3O2S — CID 164743553

IUPAC2-methyl-N-spiro[3H-furo[2,3-c]pyridine-2,4'-piperidine]-3-ylpropane-2-sulfinamide
SMILESCC(C)(C)S(=O)NC1c2ccncc2OC12CCNCC2
InChIInChI=1S/C15H23N3O2S/c1-14(2,3)21(19)18-13-11-4-7-17-10-12(11)20-15(13)5-8-16-9-6-15/h4,7,10,13,16,18H,5-6,8-9H2,1-3H3
InChIKeyUSHIHZPDMXAGFK-UHFFFAOYSA-N
MW309.44 g/mol
LogP1.69
Rot. Bonds2

About 2-methyl-N-spiro[3H-furo[2,3-c]pyridine-2,4'-piperidine]-3-ylpropane-2-sulfinamide

2-methyl-N-spiro[3H-furo[2,3-c]pyridine-2,4'-piperidine]-3-ylpropane-2-sulfinamide (PubChem CID 164743553) has the molecular formula C15H23N3O2S and a molecular weight of 309.44 g/mol. Its IUPAC name is 2-methyl-N-spiro[3H-furo[2,3-c]pyridine-2,4'-piperidine]-3-ylpropane-2-sulfinamide.

Molecular Properties

Compound Name2-methyl-N-spiro[3H-furo[2,3-c]pyridine-2,4'-piperidine]-3-ylpropane-2-sulfinamide
PubChem CID164743553
Molecular FormulaC15H23N3O2S
Molecular Weight309.44 g/mol
Exact Mass309.15
IUPAC Name2-methyl-N-spiro[3H-furo[2,3-c]pyridine-2,4'-piperidine]-3-ylpropane-2-sulfinamide
SMILESCC(C)(C)S(=O)NC1c2ccncc2OC12CCNCC2
InChIInChI=1S/C15H23N3O2S/c1-14(2,3)21(19)18-13-11-4-7-17-10-12(11)20-15(13)5-8-16-9-6-15/h4,7,10,13,16,18H,5-6,8-9H2,1-3H3
InChIKeyUSHIHZPDMXAGFK-UHFFFAOYSA-N
XLogP1.69
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.44
LogP ≤ 51.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-spiro[3H-furo[2,3-c]pyridine-2,4'-piperidine]-3-ylpropane-2-sulfinamide?
The IUPAC name of 2-methyl-N-spiro[3H-furo[2,3-c]pyridine-2,4'-piperidine]-3-ylpropane-2-sulfinamide (CID 164743553) is 2-methyl-N-spiro[3H-furo[2,3-c]pyridine-2,4'-piperidine]-3-ylpropane-2-sulfinamide.
What is the SMILES notation for 2-methyl-N-spiro[3H-furo[2,3-c]pyridine-2,4'-piperidine]-3-ylpropane-2-sulfinamide?
The canonical SMILES for 2-methyl-N-spiro[3H-furo[2,3-c]pyridine-2,4'-piperidine]-3-ylpropane-2-sulfinamide is CC(C)(C)S(=O)NC1c2ccncc2OC12CCNCC2.
What is the InChIKey of 2-methyl-N-spiro[3H-furo[2,3-c]pyridine-2,4'-piperidine]-3-ylpropane-2-sulfinamide?
The InChIKey is USHIHZPDMXAGFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O2S/c1-14(2,3)21(19)18-13-11-4-7-17-10-12(11)20-15(13)5-8-16-9-6-15/h4,7,10,13,16,18H,5-6,8-9H2,1-3H3.
What are the key properties of 2-methyl-N-spiro[3H-furo[2,3-c]pyridine-2,4'-piperidine]-3-ylpropane-2-sulfinamide?
2-methyl-N-spiro[3H-furo[2,3-c]pyridine-2,4'-piperidine]-3-ylpropane-2-sulfinamide has a molecular weight of 309.44 g/mol, XLogP of 1.69, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-spiro[3H-furo[2,3-c]pyridine-2,4'-piperidine]-3-ylpropane-2-sulfinamide is sourced from PubChem (CID 164743553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).