N-(4-amino-3,5-difluoro-2-pyridinyl)propane-1-sulfonamide;2-chloro-3-(6-methylpyrimidin-4-yl)pyrazine;N-[3,5-difluoro-4-[[3-(6-methylpyrimidin-4-yl)pyrazin-2-yl]amino]-2-pyridinyl]propane-1-sulfonamide;N-[4-[[3-[6-(ethylamino)pyrimidin-4-yl]pyrazin-2-yl]amino]-3,5-difluoro-2-pyridinyl]propane-1-sulfonamide;methane

C53H59ClF6N22O6S3 — CID 162009437

IUPACN-(4-amino-3,5-difluoro-2-pyridinyl)propane-1-sulfonamide;2-chloro-3-(6-methylpyrimidin-4-yl)pyrazine;N-[3,5-difluoro-4-[[3-(6-methylpyrimidin-4-yl)pyrazin-2-yl]amino]-2-pyridinyl]propane-1-sulfonamide;N-[4-[[3-[6-(ethylamino)pyrimidin-4-yl]pyrazin-2-yl]amino]-3,5-difluoro-2-pyridinyl]propane-1-sulfonamide;methane
SMILESC.CCCS(=O)(=O)Nc1ncc(F)c(N)c1F.CCCS(=O)(=O)Nc1ncc(F)c(Nc2nccnc2-c2cc(C)ncn2)c1F.CCCS(=O)(=O)Nc1ncc(F)c(Nc2nccnc2-c2cc(NCC)ncn2)c1F.Cc1cc(-c2nccnc2Cl)ncn1
InChIInChI=1S/C18H20F2N8O2S.C17H17F2N7O2S.C9H7ClN4.C8H11F2N3O2S.CH4/c1-3-7-31(29,30)28-17-14(20)15(11(19)9-24-17)27-18-16(22-5-6-23-18)12-8-13(21-4-2)26-10-25-12;1-3-6-29(27,28)26-16-13(19)14(11(18)8-22-16)25-17-15(20-4-5-21-17)12-7-10(2)23-9-24-12;1-6-4-7(14-5-13-6)8-9(10)12-3-2-11-8;1-2-3-16(14,15)13-8-6(10)7(11)5(9)4-12-8;/h5-6,8-10H,3-4,7H2,1-2H3,(H,21,25,26)(H2,23,24,27,28);4-5,7-9H,3,6H2,1-2H3,(H2,21,22,25,26);2-5H,1H3;4H,2-3H2,1H3,(H3,11,12,13);1H4
InChIKeyYTGSNURUNGUERK-UHFFFAOYSA-N
MW1345.84 g/mol
LogP9.37
Rot. Bonds21

About N-(4-amino-3,5-difluoro-2-pyridinyl)propane-1-sulfonamide;2-chloro-3-(6-methylpyrimidin-4-yl)pyrazine;N-[3,5-difluoro-4-[[3-(6-methylpyrimidin-4-yl)pyrazin-2-yl]amino]-2-pyridinyl]propane-1-sulfonamide;N-[4-[[3-[6-(ethylamino)pyrimidin-4-yl]pyrazin-2-yl]amino]-3,5-difluoro-2-pyridinyl]propane-1-sulfonamide;methane

N-(4-amino-3,5-difluoro-2-pyridinyl)propane-1-sulfonamide;2-chloro-3-(6-methylpyrimidin-4-yl)pyrazine;N-[3,5-difluoro-4-[[3-(6-methylpyrimidin-4-yl)pyrazin-2-yl]amino]-2-pyridinyl]propane-1-sulfonamide;N-[4-[[3-[6-(ethylamino)pyrimidin-4-yl]pyrazin-2-yl]amino]-3,5-difluoro-2-pyridinyl]propane-1-sulfonamide;methane (PubChem CID 162009437) has the molecular formula C53H59ClF6N22O6S3 and a molecular weight of 1345.84 g/mol. Its IUPAC name is N-(4-amino-3,5-difluoro-2-pyridinyl)propane-1-sulfonamide;2-chloro-3-(6-methylpyrimidin-4-yl)pyrazine;N-[3,5-difluoro-4-[[3-(6-methylpyrimidin-4-yl)pyrazin-2-yl]amino]-2-pyridinyl]propane-1-sulfonamide;N-[4-[[3-[6-(ethylamino)pyrimidin-4-yl]pyrazin-2-yl]amino]-3,5-difluoro-2-pyridinyl]propane-1-sulfonamide;methane.

Molecular Properties

Compound NameN-(4-amino-3,5-difluoro-2-pyridinyl)propane-1-sulfonamide;2-chloro-3-(6-methylpyrimidin-4-yl)pyrazine;N-[3,5-difluoro-4-[[3-(6-methylpyrimidin-4-yl)pyrazin-2-yl]amino]-2-pyridinyl]propane-1-sulfonamide;N-[4-[[3-[6-(ethylamino)pyrimidin-4-yl]pyrazin-2-yl]amino]-3,5-difluoro-2-pyridinyl]propane-1-sulfonamide;methane
PubChem CID162009437
Molecular FormulaC53H59ClF6N22O6S3
Molecular Weight1345.84 g/mol
Exact Mass1344.37
IUPAC NameN-(4-amino-3,5-difluoro-2-pyridinyl)propane-1-sulfonamide;2-chloro-3-(6-methylpyrimidin-4-yl)pyrazine;N-[3,5-difluoro-4-[[3-(6-methylpyrimidin-4-yl)pyrazin-2-yl]amino]-2-pyridinyl]propane-1-sulfonamide;N-[4-[[3-[6-(ethylamino)pyrimidin-4-yl]pyrazin-2-yl]amino]-3,5-difluoro-2-pyridinyl]propane-1-sulfonamide;methane
SMILESC.CCCS(=O)(=O)Nc1ncc(F)c(N)c1F.CCCS(=O)(=O)Nc1ncc(F)c(Nc2nccnc2-c2cc(C)ncn2)c1F.CCCS(=O)(=O)Nc1ncc(F)c(Nc2nccnc2-c2cc(NCC)ncn2)c1F.Cc1cc(-c2nccnc2Cl)ncn1
InChIInChI=1S/C18H20F2N8O2S.C17H17F2N7O2S.C9H7ClN4.C8H11F2N3O2S.CH4/c1-3-7-31(29,30)28-17-14(20)15(11(19)9-24-17)27-18-16(22-5-6-23-18)12-8-13(21-4-2)26-10-25-12;1-3-6-29(27,28)26-16-13(19)14(11(18)8-22-16)25-17-15(20-4-5-21-17)12-7-10(2)23-9-24-12;1-6-4-7(14-5-13-6)8-9(10)12-3-2-11-8;1-2-3-16(14,15)13-8-6(10)7(11)5(9)4-12-8;/h5-6,8-10H,3-4,7H2,1-2H3,(H,21,25,26)(H2,23,24,27,28);4-5,7-9H,3,6H2,1-2H3,(H2,21,22,25,26);2-5H,1H3;4H,2-3H2,1H3,(H3,11,12,13);1H4
InChIKeyYTGSNURUNGUERK-UHFFFAOYSA-N
XLogP9.37
TPSA393.97 Ų
H-Bond Donors7
H-Bond Acceptors25
Rotatable Bonds21
Heavy Atoms91
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001345.84
LogP ≤ 59.37
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1025

Analyze N-(4-amino-3,5-difluoro-2-pyridinyl)propane-1-sulfonamide;2-chloro-3-(6-methylpyrimidin-4-yl)pyrazine;N-[3,5-difluoro-4-[[3-(6-methylpyrimidin-4-yl)pyrazin-2-yl]amino]-2-pyridinyl]propane-1-sulfonamide;N-[4-[[3-[6-(ethylamino)pyrimidin-4-yl]pyrazin-2-yl]amino]-3,5-difluoro-2-pyridinyl]propane-1-sulfonamide;methane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(5-((3-(6-amino-2-methyl-4-pyrimidinyl)-2-pyrazinyl)amino)-2-chloro-3-pyridinyl)methanesulfonamide
CID 59548384
US11427567, Example 319
CID 156066031
US11427567, Example 318
CID 156066380
4-[(3-Chloro-4-fluorophenyl)amino]-6-[4-(N-methyl-N-methylsulphonylamino)-1-piperidinyl]pyrimido[5,4-d]pyrimidine
CID 18967420
N-[3-[[4-(3-chloro-4-fluoroanilino)pyrimido[5,4-d]pyrimidin-6-yl]amino]propyl]methanesulfonamide
CID 18967459
4-N-(3-chloro-4-fluorophenyl)-6-N-(1-methylsulfonylpiperidin-3-yl)pyrimido[5,4-d]pyrimidine-4,6-diamine
CID 19708965
4-N-(3-chloro-4-fluorophenyl)-6-N-[2-(4-methylsulfonylpiperazin-1-yl)ethyl]pyrimido[5,4-d]pyrimidine-4,6-diamine
CID 19709104
N-[1-[4-(3-chloro-4-fluoroanilino)pyrimido[5,4-d]pyrimidin-6-yl]piperidin-3-yl]methanesulfonamide
CID 19709128
N-[3,5-difluoro-4-[[3-[6-(3,3,3-trifluoropropylamino)pyrimidin-4-yl]pyrazin-2-yl]amino]pyridin-2-yl]propane-1-sulfonamide
CID 53353393
N-(4-(3-(6-(Ethylamino)pyrimidin-4-yl)pyrazin-2-ylamino)-3,5-difluoropyridin-2-yl)propane-1-sulfonamide
CID 53353481
N-[3,5-difluoro-4-[[3-[6-(2-methylsulfonylethylamino)pyrimidin-4-yl]pyrazin-2-yl]amino]-2-pyridinyl]propane-1-sulfonamide
CID 53353482
N-[3-chloro-4-[[3-[6-(ethylamino)pyrimidin-4-yl]pyrazin-2-yl]amino]-5-fluoro-2-pyridinyl]propane-1-sulfonamide
CID 53353483

Frequently Asked Questions

What is the IUPAC name of N-(4-amino-3,5-difluoro-2-pyridinyl)propane-1-sulfonamide;2-chloro-3-(6-methylpyrimidin-4-yl)pyrazine;N-[3,5-difluoro-4-[[3-(6-methylpyrimidin-4-yl)pyrazin-2-yl]amino]-2-pyridinyl]propane-1-sulfonamide;N-[4-[[3-[6-(ethylamino)pyrimidin-4-yl]pyrazin-2-yl]amino]-3,5-difluoro-2-pyridinyl]propane-1-sulfonamide;methane?
The IUPAC name of N-(4-amino-3,5-difluoro-2-pyridinyl)propane-1-sulfonamide;2-chloro-3-(6-methylpyrimidin-4-yl)pyrazine;N-[3,5-difluoro-4-[[3-(6-methylpyrimidin-4-yl)pyrazin-2-yl]amino]-2-pyridinyl]propane-1-sulfonamide;N-[4-[[3-[6-(ethylamino)pyrimidin-4-yl]pyrazin-2-yl]amino]-3,5-difluoro-2-pyridinyl]propane-1-sulfonamide;methane (CID 162009437) is N-(4-amino-3,5-difluoro-2-pyridinyl)propane-1-sulfonamide;2-chloro-3-(6-methylpyrimidin-4-yl)pyrazine;N-[3,5-difluoro-4-[[3-(6-methylpyrimidin-4-yl)pyrazin-2-yl]amino]-2-pyridinyl]propane-1-sulfonamide;N-[4-[[3-[6-(ethylamino)pyrimidin-4-yl]pyrazin-2-yl]amino]-3,5-difluoro-2-pyridinyl]propane-1-sulfonamide;methane.
What is the SMILES notation for N-(4-amino-3,5-difluoro-2-pyridinyl)propane-1-sulfonamide;2-chloro-3-(6-methylpyrimidin-4-yl)pyrazine;N-[3,5-difluoro-4-[[3-(6-methylpyrimidin-4-yl)pyrazin-2-yl]amino]-2-pyridinyl]propane-1-sulfonamide;N-[4-[[3-[6-(ethylamino)pyrimidin-4-yl]pyrazin-2-yl]amino]-3,5-difluoro-2-pyridinyl]propane-1-sulfonamide;methane?
The canonical SMILES for N-(4-amino-3,5-difluoro-2-pyridinyl)propane-1-sulfonamide;2-chloro-3-(6-methylpyrimidin-4-yl)pyrazine;N-[3,5-difluoro-4-[[3-(6-methylpyrimidin-4-yl)pyrazin-2-yl]amino]-2-pyridinyl]propane-1-sulfonamide;N-[4-[[3-[6-(ethylamino)pyrimidin-4-yl]pyrazin-2-yl]amino]-3,5-difluoro-2-pyridinyl]propane-1-sulfonamide;methane is C.CCCS(=O)(=O)Nc1ncc(F)c(N)c1F.CCCS(=O)(=O)Nc1ncc(F)c(Nc2nccnc2-c2cc(C)ncn2)c1F.CCCS(=O)(=O)Nc1ncc(F)c(Nc2nccnc2-c2cc(NCC)ncn2)c1F.Cc1cc(-c2nccnc2Cl)ncn1.
What is the InChIKey of N-(4-amino-3,5-difluoro-2-pyridinyl)propane-1-sulfonamide;2-chloro-3-(6-methylpyrimidin-4-yl)pyrazine;N-[3,5-difluoro-4-[[3-(6-methylpyrimidin-4-yl)pyrazin-2-yl]amino]-2-pyridinyl]propane-1-sulfonamide;N-[4-[[3-[6-(ethylamino)pyrimidin-4-yl]pyrazin-2-yl]amino]-3,5-difluoro-2-pyridinyl]propane-1-sulfonamide;methane?
The InChIKey is YTGSNURUNGUERK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20F2N8O2S.C17H17F2N7O2S.C9H7ClN4.C8H11F2N3O2S.CH4/c1-3-7-31(29,30)28-17-14(20)15(11(19)9-24-17)27-18-16(22-5-6-23-18)12-8-13(21-4-2)26-10-25-12;1-3-6-29(27,28)26-16-13(19)14(11(18)8-22-16)25-17-15(20-4-5-21-17)12-7-10(2)23-9-24-12;1-6-4-7(14-5-13-6)8-9(10)12-3-2-11-8;1-2-3-16(14,15)13-8-6(10)7(11)5(9)4-12-8;/h5-6,8-10H,3-4,7H2,1-2H3,(H,21,25,26)(H2,23,24,27,28);4-5,7-9H,3,6H2,1-2H3,(H2,21,22,25,26);2-5H,1H3;4H,2-3H2,1H3,(H3,11,12,13);1H4.
What are the key properties of N-(4-amino-3,5-difluoro-2-pyridinyl)propane-1-sulfonamide;2-chloro-3-(6-methylpyrimidin-4-yl)pyrazine;N-[3,5-difluoro-4-[[3-(6-methylpyrimidin-4-yl)pyrazin-2-yl]amino]-2-pyridinyl]propane-1-sulfonamide;N-[4-[[3-[6-(ethylamino)pyrimidin-4-yl]pyrazin-2-yl]amino]-3,5-difluoro-2-pyridinyl]propane-1-sulfonamide;methane?
N-(4-amino-3,5-difluoro-2-pyridinyl)propane-1-sulfonamide;2-chloro-3-(6-methylpyrimidin-4-yl)pyrazine;N-[3,5-difluoro-4-[[3-(6-methylpyrimidin-4-yl)pyrazin-2-yl]amino]-2-pyridinyl]propane-1-sulfonamide;N-[4-[[3-[6-(ethylamino)pyrimidin-4-yl]pyrazin-2-yl]amino]-3,5-difluoro-2-pyridinyl]propane-1-sulfonamide;methane has a molecular weight of 1345.84 g/mol, XLogP of 9.37, 21 rotatable bonds, 7 hydrogen bond donors, and 25 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-amino-3,5-difluoro-2-pyridinyl)propane-1-sulfonamide;2-chloro-3-(6-methylpyrimidin-4-yl)pyrazine;N-[3,5-difluoro-4-[[3-(6-methylpyrimidin-4-yl)pyrazin-2-yl]amino]-2-pyridinyl]propane-1-sulfonamide;N-[4-[[3-[6-(ethylamino)pyrimidin-4-yl]pyrazin-2-yl]amino]-3,5-difluoro-2-pyridinyl]propane-1-sulfonamide;methane is sourced from PubChem (CID 162009437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).