N-[4-[5-[(4-fluoro-2-methoxyphenyl)sulfonylamino]-6-methyl-3-pyridinyl]-2-pyridinyl]acetamide

C20H19FN4O4S — CID 118293510

IUPACN-[4-[5-[(4-fluoro-2-methoxyphenyl)sulfonylamino]-6-methyl-3-pyridinyl]-2-pyridinyl]acetamide
SMILESCOc1cc(F)ccc1S(=O)(=O)Nc1cc(-c2ccnc(NC(C)=O)c2)cnc1C
InChIInChI=1S/C20H19FN4O4S/c1-12-17(25-30(27,28)19-5-4-16(21)10-18(19)29-3)8-15(11-23-12)14-6-7-22-20(9-14)24-13(2)26/h4-11,25H,1-3H3,(H,22,24,26)
InChIKeyITOMXAJBDFADMU-UHFFFAOYSA-N
MW430.46 g/mol
LogP3.36
Rot. Bonds6

About N-[4-[5-[(4-fluoro-2-methoxyphenyl)sulfonylamino]-6-methyl-3-pyridinyl]-2-pyridinyl]acetamide

N-[4-[5-[(4-fluoro-2-methoxyphenyl)sulfonylamino]-6-methyl-3-pyridinyl]-2-pyridinyl]acetamide (PubChem CID 118293510) has the molecular formula C20H19FN4O4S and a molecular weight of 430.46 g/mol. Its IUPAC name is N-[4-[5-[(4-fluoro-2-methoxyphenyl)sulfonylamino]-6-methyl-3-pyridinyl]-2-pyridinyl]acetamide.

Molecular Properties

Compound NameN-[4-[5-[(4-fluoro-2-methoxyphenyl)sulfonylamino]-6-methyl-3-pyridinyl]-2-pyridinyl]acetamide
PubChem CID118293510
Molecular FormulaC20H19FN4O4S
Molecular Weight430.46 g/mol
Exact Mass430.11
IUPAC NameN-[4-[5-[(4-fluoro-2-methoxyphenyl)sulfonylamino]-6-methyl-3-pyridinyl]-2-pyridinyl]acetamide
SMILESCOc1cc(F)ccc1S(=O)(=O)Nc1cc(-c2ccnc(NC(C)=O)c2)cnc1C
InChIInChI=1S/C20H19FN4O4S/c1-12-17(25-30(27,28)19-5-4-16(21)10-18(19)29-3)8-15(11-23-12)14-6-7-22-20(9-14)24-13(2)26/h4-11,25H,1-3H3,(H,22,24,26)
InChIKeyITOMXAJBDFADMU-UHFFFAOYSA-N
XLogP3.36
TPSA110.28 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500430.46
LogP ≤ 53.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze N-[4-[5-[(4-fluoro-2-methoxyphenyl)sulfonylamino]-6-methyl-3-pyridinyl]-2-pyridinyl]acetamide with MolForge

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Related Compounds

3-amino-N-(4-methoxyphenyl)-6-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]pyrazine-2-carboxamide
CID 10006844
N-(4-fluorophenyl)-1-(4-methoxyphenyl)sulfonylpyrrolo[2,3-c]pyridin-7-amine
CID 50940069
4-(2,6-Difluoro-4-methoxybenzyl)-2-[6-methoxy-5-(methylamino)pyridin-3-yl]-2H-pyrido[2,3-e][1,2,4]thiadiazin-3(4H)-one 1,1-dioxide
CID 72720982
N-[5-(2-aminopyrimidin-5-yl)-3-pyridinyl]-4-methoxybenzenesulfonamide
CID 57390852
2-fluoro-N-(4-methoxyphenyl)-5-(4-pyridin-2-ylpiperazin-1-yl)sulfonylbenzamide
CID 15999732
2-(2-methoxy-N-(4-methylphenyl)sulfonylanilino)-N-(3-methoxy-2-pyridinyl)acetamide
CID 127052537
N-[5-(6-amino-3-pyridinyl)-2-methoxy-3-pyridinyl]benzenesulfonamide
CID 141461668
US10370333, Example XIII-10
CID 89768459
US10370333, Example XIII-7
CID 89768657
N-[4-[5-[[2-chloro-4-(trifluoromethoxy)phenyl]sulfonylamino]-6-methylpyridin-3-yl]pyridin-2-yl]acetamide
CID 118248970
N-[4-[5-(7-fluoro-1,1-dioxo-3,4-dihydro-5,1lambda6,2-benzoxathiazepin-2-yl)-3-pyridinyl]-2-pyridinyl]acetamide
CID 118249051
N-[4-[5-[(3-fluorophenyl)sulfonylamino]-6-methyl-3-pyridinyl]-2-pyridinyl]acetamide
CID 118249082

Frequently Asked Questions

What is the IUPAC name of N-[4-[5-[(4-fluoro-2-methoxyphenyl)sulfonylamino]-6-methyl-3-pyridinyl]-2-pyridinyl]acetamide?
The IUPAC name of N-[4-[5-[(4-fluoro-2-methoxyphenyl)sulfonylamino]-6-methyl-3-pyridinyl]-2-pyridinyl]acetamide (CID 118293510) is N-[4-[5-[(4-fluoro-2-methoxyphenyl)sulfonylamino]-6-methyl-3-pyridinyl]-2-pyridinyl]acetamide.
What is the SMILES notation for N-[4-[5-[(4-fluoro-2-methoxyphenyl)sulfonylamino]-6-methyl-3-pyridinyl]-2-pyridinyl]acetamide?
The canonical SMILES for N-[4-[5-[(4-fluoro-2-methoxyphenyl)sulfonylamino]-6-methyl-3-pyridinyl]-2-pyridinyl]acetamide is COc1cc(F)ccc1S(=O)(=O)Nc1cc(-c2ccnc(NC(C)=O)c2)cnc1C.
What is the InChIKey of N-[4-[5-[(4-fluoro-2-methoxyphenyl)sulfonylamino]-6-methyl-3-pyridinyl]-2-pyridinyl]acetamide?
The InChIKey is ITOMXAJBDFADMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19FN4O4S/c1-12-17(25-30(27,28)19-5-4-16(21)10-18(19)29-3)8-15(11-23-12)14-6-7-22-20(9-14)24-13(2)26/h4-11,25H,1-3H3,(H,22,24,26).
What are the key properties of N-[4-[5-[(4-fluoro-2-methoxyphenyl)sulfonylamino]-6-methyl-3-pyridinyl]-2-pyridinyl]acetamide?
N-[4-[5-[(4-fluoro-2-methoxyphenyl)sulfonylamino]-6-methyl-3-pyridinyl]-2-pyridinyl]acetamide has a molecular weight of 430.46 g/mol, XLogP of 3.36, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[5-[(4-fluoro-2-methoxyphenyl)sulfonylamino]-6-methyl-3-pyridinyl]-2-pyridinyl]acetamide is sourced from PubChem (CID 118293510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).