6-acetamido-N-[2,6-difluoro-3-(sulfonylamino)phenyl]pyridine-3-carboxamide

C14H10F2N4O4S — CID 121392864

IUPAC6-acetamido-N-[2,6-difluoro-3-(sulfonylamino)phenyl]pyridine-3-carboxamide
SMILESCC(=O)Nc1ccc(C(=O)Nc2c(F)ccc(N=S(=O)=O)c2F)cn1
InChIInChI=1S/C14H10F2N4O4S/c1-7(21)18-11-5-2-8(6-17-11)14(22)19-13-9(15)3-4-10(12(13)16)20-25(23)24/h2-6H,1H3,(H,19,22)(H,17,18,21)
InChIKeyNWGFYVLZHVCEIE-UHFFFAOYSA-N
MW368.32 g/mol
LogP2.26
Rot. Bonds4

About 6-acetamido-N-[2,6-difluoro-3-(sulfonylamino)phenyl]pyridine-3-carboxamide

6-acetamido-N-[2,6-difluoro-3-(sulfonylamino)phenyl]pyridine-3-carboxamide (PubChem CID 121392864) has the molecular formula C14H10F2N4O4S and a molecular weight of 368.32 g/mol. Its IUPAC name is 6-acetamido-N-[2,6-difluoro-3-(sulfonylamino)phenyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-acetamido-N-[2,6-difluoro-3-(sulfonylamino)phenyl]pyridine-3-carboxamide
PubChem CID121392864
Molecular FormulaC14H10F2N4O4S
Molecular Weight368.32 g/mol
Exact Mass368.04
IUPAC Name6-acetamido-N-[2,6-difluoro-3-(sulfonylamino)phenyl]pyridine-3-carboxamide
SMILESCC(=O)Nc1ccc(C(=O)Nc2c(F)ccc(N=S(=O)=O)c2F)cn1
InChIInChI=1S/C14H10F2N4O4S/c1-7(21)18-11-5-2-8(6-17-11)14(22)19-13-9(15)3-4-10(12(13)16)20-25(23)24/h2-6H,1H3,(H,19,22)(H,17,18,21)
InChIKeyNWGFYVLZHVCEIE-UHFFFAOYSA-N
XLogP2.26
TPSA117.59 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.32
LogP ≤ 52.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-acetamido-5-[[2,6-difluoro-3-(sulfinoamino)phenyl]carbamoyl]pyridine
CID 71035936
N-(2,6-difluoro-3-methylphenyl)-6-hydrazinylpyridine-3-carboxamide
CID 82819363
4-[3-[(6-acetamidopyridine-3-carbonyl)amino]-2,4-difluoro-N-sulfinatoanilino]morpholine
CID 91601945
6-acetamido-N-[2,6-difluoro-3-(pyrrolidin-1-ylsulfonylamino)phenyl]pyridine-3-carboxamide
CID 59418562
6-acetamido-N-[2,6-difluoro-3-(piperidin-1-ylsulfonylamino)phenyl]pyridine-3-carboxamide
CID 59418536
N-(5-chloro-2-fluorophenyl)-6-(methylamino)pyridine-3-carboxamide
CID 62169857
N-(5-fluoro-2-pyridinyl)-6-(methylamino)pyridine-3-carboxamide
CID 65482281
6-[(2,6-difluoro-3-methylphenyl)carbamoyl]pyridine-3-carboxylic acid
CID 82803080
6-(4-acetamidoanilino)-N-(4-fluorophenyl)pyridine-3-carboxamide
CID 109163310
N-[5-(2-hydroxyacetyl)-2-pyridinyl]acetamide
CID 15512450
N-(3-acetamido-4-fluorophenyl)-6-fluoropyridine-3-carboxamide
CID 63971441
6-amino-N-(2,6-difluorophenyl)pyridine-3-carboxamide
CID 62155427

Frequently Asked Questions

What is the IUPAC name of 6-acetamido-N-[2,6-difluoro-3-(sulfonylamino)phenyl]pyridine-3-carboxamide?
The IUPAC name of 6-acetamido-N-[2,6-difluoro-3-(sulfonylamino)phenyl]pyridine-3-carboxamide (CID 121392864) is 6-acetamido-N-[2,6-difluoro-3-(sulfonylamino)phenyl]pyridine-3-carboxamide.
What is the SMILES notation for 6-acetamido-N-[2,6-difluoro-3-(sulfonylamino)phenyl]pyridine-3-carboxamide?
The canonical SMILES for 6-acetamido-N-[2,6-difluoro-3-(sulfonylamino)phenyl]pyridine-3-carboxamide is CC(=O)Nc1ccc(C(=O)Nc2c(F)ccc(N=S(=O)=O)c2F)cn1.
What is the InChIKey of 6-acetamido-N-[2,6-difluoro-3-(sulfonylamino)phenyl]pyridine-3-carboxamide?
The InChIKey is NWGFYVLZHVCEIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10F2N4O4S/c1-7(21)18-11-5-2-8(6-17-11)14(22)19-13-9(15)3-4-10(12(13)16)20-25(23)24/h2-6H,1H3,(H,19,22)(H,17,18,21).
What are the key properties of 6-acetamido-N-[2,6-difluoro-3-(sulfonylamino)phenyl]pyridine-3-carboxamide?
6-acetamido-N-[2,6-difluoro-3-(sulfonylamino)phenyl]pyridine-3-carboxamide has a molecular weight of 368.32 g/mol, XLogP of 2.26, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-acetamido-N-[2,6-difluoro-3-(sulfonylamino)phenyl]pyridine-3-carboxamide is sourced from PubChem (CID 121392864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).