N-[(4-piperidin-1-ylsulfonylphenyl)methyl]furo[2,3-c]pyridine-2-carboxamide

C20H21N3O4S — CID 71818155

IUPACN-[(4-piperidin-1-ylsulfonylphenyl)methyl]furo[2,3-c]pyridine-2-carboxamide
SMILESO=C(NCc1ccc(S(=O)(=O)N2CCCCC2)cc1)c1cc2ccncc2o1
InChIInChI=1S/C20H21N3O4S/c24-20(18-12-16-8-9-21-14-19(16)27-18)22-13-15-4-6-17(7-5-15)28(25,26)23-10-2-1-3-11-23/h4-9,12,14H,1-3,10-11,13H2,(H,22,24)
InChIKeyDECKULRTSATQFL-UHFFFAOYSA-N
MW399.47 g/mol
LogP2.93
Rot. Bonds5

About N-[(4-piperidin-1-ylsulfonylphenyl)methyl]furo[2,3-c]pyridine-2-carboxamide

N-[(4-piperidin-1-ylsulfonylphenyl)methyl]furo[2,3-c]pyridine-2-carboxamide (PubChem CID 71818155) has the molecular formula C20H21N3O4S and a molecular weight of 399.47 g/mol. Its IUPAC name is N-[(4-piperidin-1-ylsulfonylphenyl)methyl]furo[2,3-c]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[(4-piperidin-1-ylsulfonylphenyl)methyl]furo[2,3-c]pyridine-2-carboxamide
PubChem CID71818155
Molecular FormulaC20H21N3O4S
Molecular Weight399.47 g/mol
Exact Mass399.13
IUPAC NameN-[(4-piperidin-1-ylsulfonylphenyl)methyl]furo[2,3-c]pyridine-2-carboxamide
SMILESO=C(NCc1ccc(S(=O)(=O)N2CCCCC2)cc1)c1cc2ccncc2o1
InChIInChI=1S/C20H21N3O4S/c24-20(18-12-16-8-9-21-14-19(16)27-18)22-13-15-4-6-17(7-5-15)28(25,26)23-10-2-1-3-11-23/h4-9,12,14H,1-3,10-11,13H2,(H,22,24)
InChIKeyDECKULRTSATQFL-UHFFFAOYSA-N
XLogP2.93
TPSA92.51 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500399.47
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[(4-piperidin-1-ylsulfonylphenyl)methyl]furo[2,3-c]pyridine-2-carboxamide?
The IUPAC name of N-[(4-piperidin-1-ylsulfonylphenyl)methyl]furo[2,3-c]pyridine-2-carboxamide (CID 71818155) is N-[(4-piperidin-1-ylsulfonylphenyl)methyl]furo[2,3-c]pyridine-2-carboxamide.
What is the SMILES notation for N-[(4-piperidin-1-ylsulfonylphenyl)methyl]furo[2,3-c]pyridine-2-carboxamide?
The canonical SMILES for N-[(4-piperidin-1-ylsulfonylphenyl)methyl]furo[2,3-c]pyridine-2-carboxamide is O=C(NCc1ccc(S(=O)(=O)N2CCCCC2)cc1)c1cc2ccncc2o1.
What is the InChIKey of N-[(4-piperidin-1-ylsulfonylphenyl)methyl]furo[2,3-c]pyridine-2-carboxamide?
The InChIKey is DECKULRTSATQFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N3O4S/c24-20(18-12-16-8-9-21-14-19(16)27-18)22-13-15-4-6-17(7-5-15)28(25,26)23-10-2-1-3-11-23/h4-9,12,14H,1-3,10-11,13H2,(H,22,24).
What are the key properties of N-[(4-piperidin-1-ylsulfonylphenyl)methyl]furo[2,3-c]pyridine-2-carboxamide?
N-[(4-piperidin-1-ylsulfonylphenyl)methyl]furo[2,3-c]pyridine-2-carboxamide has a molecular weight of 399.47 g/mol, XLogP of 2.93, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-piperidin-1-ylsulfonylphenyl)methyl]furo[2,3-c]pyridine-2-carboxamide is sourced from PubChem (CID 71818155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).