N-[4-[5-[(2,5-difluorophenyl)sulfamoyl]-6-methoxy-3-pyridinyl]-2-pyridinyl]acetamide

C19H16F2N4O4S — CID 118249122

IUPACN-[4-[5-[(2,5-difluorophenyl)sulfamoyl]-6-methoxy-3-pyridinyl]-2-pyridinyl]acetamide
SMILESCOc1ncc(-c2ccnc(NC(C)=O)c2)cc1S(=O)(=O)Nc1cc(F)ccc1F
InChIInChI=1S/C19H16F2N4O4S/c1-11(26)24-18-8-12(5-6-22-18)13-7-17(19(29-2)23-10-13)30(27,28)25-16-9-14(20)3-4-15(16)21/h3-10,25H,1-2H3,(H,22,24,26)
InChIKeyWMAZMTXSKPACOB-UHFFFAOYSA-N
MW434.42 g/mol
LogP3.19
Rot. Bonds6

About N-[4-[5-[(2,5-difluorophenyl)sulfamoyl]-6-methoxy-3-pyridinyl]-2-pyridinyl]acetamide

N-[4-[5-[(2,5-difluorophenyl)sulfamoyl]-6-methoxy-3-pyridinyl]-2-pyridinyl]acetamide (PubChem CID 118249122) has the molecular formula C19H16F2N4O4S and a molecular weight of 434.42 g/mol. Its IUPAC name is N-[4-[5-[(2,5-difluorophenyl)sulfamoyl]-6-methoxy-3-pyridinyl]-2-pyridinyl]acetamide.

Molecular Properties

Compound NameN-[4-[5-[(2,5-difluorophenyl)sulfamoyl]-6-methoxy-3-pyridinyl]-2-pyridinyl]acetamide
PubChem CID118249122
Molecular FormulaC19H16F2N4O4S
Molecular Weight434.42 g/mol
Exact Mass434.09
IUPAC NameN-[4-[5-[(2,5-difluorophenyl)sulfamoyl]-6-methoxy-3-pyridinyl]-2-pyridinyl]acetamide
SMILESCOc1ncc(-c2ccnc(NC(C)=O)c2)cc1S(=O)(=O)Nc1cc(F)ccc1F
InChIInChI=1S/C19H16F2N4O4S/c1-11(26)24-18-8-12(5-6-22-18)13-7-17(19(29-2)23-10-13)30(27,28)25-16-9-14(20)3-4-15(16)21/h3-10,25H,1-2H3,(H,22,24,26)
InChIKeyWMAZMTXSKPACOB-UHFFFAOYSA-N
XLogP3.19
TPSA110.28 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500434.42
LogP ≤ 53.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

4-[6-amino-5-(6-methoxy-3-pyridyl)-3-pyridyl]-N,N-dimethyl-benzenesulfonamide
CID 53312065
4-[6-amino-5-(6-methoxy-3-pyridyl)-3-pyridyl]-N-methyl-benzenesulfonamide
CID 53312148
4-[6-amino-5-(6-methoxy-3-pyridyl)-3-pyridyl]-N-cyclopropyl-benzenesulfonamide
CID 67325548
N-[4-[6-amino-5-(6-methoxy-3-pyridyl)-3-pyridyl]phenyl]methanesulfonamide
CID 71461081
4-[6-Amino-5-(6-methoxy-3-pyridyl)-3-pyridyl]benzenesulfonamide
CID 53311066
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-[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]-5-(trifluoromethyl)pyridin-2-amine
CID 26045740
N-[5-(6-amino-3-pyridinyl)-2-methoxy-3-pyridinyl]benzenesulfonamide
CID 141461668
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-[(2,4-difluorophenyl)sulfamoyl]-6-(methylamino)-3-pyridinyl]-2-pyridinyl]acetamide
CID 118249084
N-[4-[5-[(2,4-difluorophenyl)sulfamoyl]-6-(dimethylamino)-3-pyridinyl]-2-pyridinyl]acetamide
CID 118249313
N-[4-[6-methoxy-5-[[3-(trifluoromethyl)phenyl]sulfamoyl]pyridin-3-yl]pyridin-2-yl]acetamide
CID 118249429

Frequently Asked Questions

What is the IUPAC name of N-[4-[5-[(2,5-difluorophenyl)sulfamoyl]-6-methoxy-3-pyridinyl]-2-pyridinyl]acetamide?
The IUPAC name of N-[4-[5-[(2,5-difluorophenyl)sulfamoyl]-6-methoxy-3-pyridinyl]-2-pyridinyl]acetamide (CID 118249122) is N-[4-[5-[(2,5-difluorophenyl)sulfamoyl]-6-methoxy-3-pyridinyl]-2-pyridinyl]acetamide.
What is the SMILES notation for N-[4-[5-[(2,5-difluorophenyl)sulfamoyl]-6-methoxy-3-pyridinyl]-2-pyridinyl]acetamide?
The canonical SMILES for N-[4-[5-[(2,5-difluorophenyl)sulfamoyl]-6-methoxy-3-pyridinyl]-2-pyridinyl]acetamide is COc1ncc(-c2ccnc(NC(C)=O)c2)cc1S(=O)(=O)Nc1cc(F)ccc1F.
What is the InChIKey of N-[4-[5-[(2,5-difluorophenyl)sulfamoyl]-6-methoxy-3-pyridinyl]-2-pyridinyl]acetamide?
The InChIKey is WMAZMTXSKPACOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16F2N4O4S/c1-11(26)24-18-8-12(5-6-22-18)13-7-17(19(29-2)23-10-13)30(27,28)25-16-9-14(20)3-4-15(16)21/h3-10,25H,1-2H3,(H,22,24,26).
What are the key properties of N-[4-[5-[(2,5-difluorophenyl)sulfamoyl]-6-methoxy-3-pyridinyl]-2-pyridinyl]acetamide?
N-[4-[5-[(2,5-difluorophenyl)sulfamoyl]-6-methoxy-3-pyridinyl]-2-pyridinyl]acetamide has a molecular weight of 434.42 g/mol, XLogP of 3.19, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[5-[(2,5-difluorophenyl)sulfamoyl]-6-methoxy-3-pyridinyl]-2-pyridinyl]acetamide is sourced from PubChem (CID 118249122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).