N-[4-[6-amino-5-(dimethylsulfamoyl)-3-pyridinyl]-5-fluoro-2-pyridinyl]acetamide

C14H16FN5O3S — CID 118249009

IUPACN-[4-[6-amino-5-(dimethylsulfamoyl)-3-pyridinyl]-5-fluoro-2-pyridinyl]acetamide
SMILESCC(=O)Nc1cc(-c2cnc(N)c(S(=O)(=O)N(C)C)c2)c(F)cn1
InChIInChI=1S/C14H16FN5O3S/c1-8(21)19-13-5-10(11(15)7-17-13)9-4-12(14(16)18-6-9)24(22,23)20(2)3/h4-7H,1-3H3,(H2,16,18)(H,17,19,21)
InChIKeyGQQKSXCXUAURRE-UHFFFAOYSA-N
MW353.38 g/mol
LogP1.07
Rot. Bonds4

About N-[4-[6-amino-5-(dimethylsulfamoyl)-3-pyridinyl]-5-fluoro-2-pyridinyl]acetamide

N-[4-[6-amino-5-(dimethylsulfamoyl)-3-pyridinyl]-5-fluoro-2-pyridinyl]acetamide (PubChem CID 118249009) has the molecular formula C14H16FN5O3S and a molecular weight of 353.38 g/mol. Its IUPAC name is N-[4-[6-amino-5-(dimethylsulfamoyl)-3-pyridinyl]-5-fluoro-2-pyridinyl]acetamide.

Molecular Properties

Compound NameN-[4-[6-amino-5-(dimethylsulfamoyl)-3-pyridinyl]-5-fluoro-2-pyridinyl]acetamide
PubChem CID118249009
Molecular FormulaC14H16FN5O3S
Molecular Weight353.38 g/mol
Exact Mass353.10
IUPAC NameN-[4-[6-amino-5-(dimethylsulfamoyl)-3-pyridinyl]-5-fluoro-2-pyridinyl]acetamide
SMILESCC(=O)Nc1cc(-c2cnc(N)c(S(=O)(=O)N(C)C)c2)c(F)cn1
InChIInChI=1S/C14H16FN5O3S/c1-8(21)19-13-5-10(11(15)7-17-13)9-4-12(14(16)18-6-9)24(22,23)20(2)3/h4-7H,1-3H3,(H2,16,18)(H,17,19,21)
InChIKeyGQQKSXCXUAURRE-UHFFFAOYSA-N
XLogP1.07
TPSA118.28 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.38
LogP ≤ 51.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[4-[6-amino-5-(dimethylsulfamoyl)-3-pyridinyl]-5-fluoro-2-pyridinyl]acetamide?
The IUPAC name of N-[4-[6-amino-5-(dimethylsulfamoyl)-3-pyridinyl]-5-fluoro-2-pyridinyl]acetamide (CID 118249009) is N-[4-[6-amino-5-(dimethylsulfamoyl)-3-pyridinyl]-5-fluoro-2-pyridinyl]acetamide.
What is the SMILES notation for N-[4-[6-amino-5-(dimethylsulfamoyl)-3-pyridinyl]-5-fluoro-2-pyridinyl]acetamide?
The canonical SMILES for N-[4-[6-amino-5-(dimethylsulfamoyl)-3-pyridinyl]-5-fluoro-2-pyridinyl]acetamide is CC(=O)Nc1cc(-c2cnc(N)c(S(=O)(=O)N(C)C)c2)c(F)cn1.
What is the InChIKey of N-[4-[6-amino-5-(dimethylsulfamoyl)-3-pyridinyl]-5-fluoro-2-pyridinyl]acetamide?
The InChIKey is GQQKSXCXUAURRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16FN5O3S/c1-8(21)19-13-5-10(11(15)7-17-13)9-4-12(14(16)18-6-9)24(22,23)20(2)3/h4-7H,1-3H3,(H2,16,18)(H,17,19,21).
What are the key properties of N-[4-[6-amino-5-(dimethylsulfamoyl)-3-pyridinyl]-5-fluoro-2-pyridinyl]acetamide?
N-[4-[6-amino-5-(dimethylsulfamoyl)-3-pyridinyl]-5-fluoro-2-pyridinyl]acetamide has a molecular weight of 353.38 g/mol, XLogP of 1.07, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[6-amino-5-(dimethylsulfamoyl)-3-pyridinyl]-5-fluoro-2-pyridinyl]acetamide is sourced from PubChem (CID 118249009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).