N-[[5-[(6-methyl-3-pyridinyl)sulfonyl]-2-pyridinyl]methyl]furo[2,3-c]pyridine-2-carboxamide

C20H16N4O4S — CID 118193544

IUPACN-[[5-[(6-methyl-3-pyridinyl)sulfonyl]-2-pyridinyl]methyl]furo[2,3-c]pyridine-2-carboxamide
SMILESCc1ccc(S(=O)(=O)c2ccc(CNC(=O)c3cc4ccncc4o3)nc2)cn1
InChIInChI=1S/C20H16N4O4S/c1-13-2-4-16(10-22-13)29(26,27)17-5-3-15(23-11-17)9-24-20(25)18-8-14-6-7-21-12-19(14)28-18/h2-8,10-12H,9H2,1H3,(H,24,25)
InChIKeyKVJGMFFMXAMGOU-UHFFFAOYSA-N
MW408.44 g/mol
LogP2.69
Rot. Bonds5

About N-[[5-[(6-methyl-3-pyridinyl)sulfonyl]-2-pyridinyl]methyl]furo[2,3-c]pyridine-2-carboxamide

N-[[5-[(6-methyl-3-pyridinyl)sulfonyl]-2-pyridinyl]methyl]furo[2,3-c]pyridine-2-carboxamide (PubChem CID 118193544) has the molecular formula C20H16N4O4S and a molecular weight of 408.44 g/mol. Its IUPAC name is N-[[5-[(6-methyl-3-pyridinyl)sulfonyl]-2-pyridinyl]methyl]furo[2,3-c]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[[5-[(6-methyl-3-pyridinyl)sulfonyl]-2-pyridinyl]methyl]furo[2,3-c]pyridine-2-carboxamide
PubChem CID118193544
Molecular FormulaC20H16N4O4S
Molecular Weight408.44 g/mol
Exact Mass408.09
IUPAC NameN-[[5-[(6-methyl-3-pyridinyl)sulfonyl]-2-pyridinyl]methyl]furo[2,3-c]pyridine-2-carboxamide
SMILESCc1ccc(S(=O)(=O)c2ccc(CNC(=O)c3cc4ccncc4o3)nc2)cn1
InChIInChI=1S/C20H16N4O4S/c1-13-2-4-16(10-22-13)29(26,27)17-5-3-15(23-11-17)9-24-20(25)18-8-14-6-7-21-12-19(14)28-18/h2-8,10-12H,9H2,1H3,(H,24,25)
InChIKeyKVJGMFFMXAMGOU-UHFFFAOYSA-N
XLogP2.69
TPSA115.05 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500408.44
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-[[5-[(6-methyl-3-pyridinyl)sulfonyl]-2-pyridinyl]methyl]furo[2,3-c]pyridine-2-carboxamide?
The IUPAC name of N-[[5-[(6-methyl-3-pyridinyl)sulfonyl]-2-pyridinyl]methyl]furo[2,3-c]pyridine-2-carboxamide (CID 118193544) is N-[[5-[(6-methyl-3-pyridinyl)sulfonyl]-2-pyridinyl]methyl]furo[2,3-c]pyridine-2-carboxamide.
What is the SMILES notation for N-[[5-[(6-methyl-3-pyridinyl)sulfonyl]-2-pyridinyl]methyl]furo[2,3-c]pyridine-2-carboxamide?
The canonical SMILES for N-[[5-[(6-methyl-3-pyridinyl)sulfonyl]-2-pyridinyl]methyl]furo[2,3-c]pyridine-2-carboxamide is Cc1ccc(S(=O)(=O)c2ccc(CNC(=O)c3cc4ccncc4o3)nc2)cn1.
What is the InChIKey of N-[[5-[(6-methyl-3-pyridinyl)sulfonyl]-2-pyridinyl]methyl]furo[2,3-c]pyridine-2-carboxamide?
The InChIKey is KVJGMFFMXAMGOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16N4O4S/c1-13-2-4-16(10-22-13)29(26,27)17-5-3-15(23-11-17)9-24-20(25)18-8-14-6-7-21-12-19(14)28-18/h2-8,10-12H,9H2,1H3,(H,24,25).
What are the key properties of N-[[5-[(6-methyl-3-pyridinyl)sulfonyl]-2-pyridinyl]methyl]furo[2,3-c]pyridine-2-carboxamide?
N-[[5-[(6-methyl-3-pyridinyl)sulfonyl]-2-pyridinyl]methyl]furo[2,3-c]pyridine-2-carboxamide has a molecular weight of 408.44 g/mol, XLogP of 2.69, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-[(6-methyl-3-pyridinyl)sulfonyl]-2-pyridinyl]methyl]furo[2,3-c]pyridine-2-carboxamide is sourced from PubChem (CID 118193544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).