N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-(2-methylpiperidin-1-yl)pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-(7-oxa-1-azaspiro[4.4]nonan-1-yl)pyridine-3-carboxamide;6-[3-fluoro-5-(2-methylpropoxy)phenyl]-N-(1H-pyrazol-5-ylsulfonyl)-2-[4-(trifluoromethyl)piperidin-1-yl]pyridine-3-carboxamide

C80H91F6N15O13S3 — CID 159043721

IUPACN-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-(2-methylpiperidin-1-yl)pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-(7-oxa-1-azaspiro[4.4]nonan-1-yl)pyridine-3-carboxamide;6-[3-fluoro-5-(2-methylpropoxy)phenyl]-N-(1H-pyrazol-5-ylsulfonyl)-2-[4-(trifluoromethyl)piperidin-1-yl]pyridine-3-carboxamide
SMILESCC(C)COc1cc(F)cc(-c2ccc(C(=O)NS(=O)(=O)c3cccc(N)n3)c(N3CCCC34CCOC4)n2)c1.CC(C)COc1cc(F)cc(-c2ccc(C(=O)NS(=O)(=O)c3cccc(N)n3)c(N3CCCCC3C)n2)c1.CC(C)COc1cc(F)cc(-c2ccc(C(=O)NS(=O)(=O)c3ccn[nH]3)c(N3CCC(C(F)(F)F)CC3)n2)c1
InChIInChI=1S/C28H32FN5O5S.C27H32FN5O4S.C25H27F4N5O4S/c1-18(2)16-39-21-14-19(13-20(29)15-21)23-8-7-22(26(31-23)34-11-4-9-28(34)10-12-38-17-28)27(35)33-40(36,37)25-6-3-5-24(30)32-25;1-17(2)16-37-21-14-19(13-20(28)15-21)23-11-10-22(26(30-23)33-12-5-4-7-18(33)3)27(34)32-38(35,36)25-9-6-8-24(29)31-25;1-15(2)14-38-19-12-16(11-18(26)13-19)21-4-3-20(24(35)33-39(36,37)22-5-8-30-32-22)23(31-21)34-9-6-17(7-10-34)25(27,28)29/h3,5-8,13-15,18H,4,9-12,16-17H2,1-2H3,(H2,30,32)(H,33,35);6,8-11,13-15,17-18H,4-5,7,12,16H2,1-3H3,(H2,29,31)(H,32,34);3-5,8,11-13,15,17H,6-7,9-10,14H2,1-2H3,(H,30,32)(H,33,35)
InChIKeyJWJWNCLENAYSPE-UHFFFAOYSA-N
MW1680.89 g/mol
LogP12.72
Rot. Bonds24

About N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-(2-methylpiperidin-1-yl)pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-(7-oxa-1-azaspiro[4.4]nonan-1-yl)pyridine-3-carboxamide;6-[3-fluoro-5-(2-methylpropoxy)phenyl]-N-(1H-pyrazol-5-ylsulfonyl)-2-[4-(trifluoromethyl)piperidin-1-yl]pyridine-3-carboxamide

N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-(2-methylpiperidin-1-yl)pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-(7-oxa-1-azaspiro[4.4]nonan-1-yl)pyridine-3-carboxamide;6-[3-fluoro-5-(2-methylpropoxy)phenyl]-N-(1H-pyrazol-5-ylsulfonyl)-2-[4-(trifluoromethyl)piperidin-1-yl]pyridine-3-carboxamide (PubChem CID 159043721) has the molecular formula C80H91F6N15O13S3 and a molecular weight of 1680.89 g/mol. Its IUPAC name is N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-(2-methylpiperidin-1-yl)pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-(7-oxa-1-azaspiro[4.4]nonan-1-yl)pyridine-3-carboxamide;6-[3-fluoro-5-(2-methylpropoxy)phenyl]-N-(1H-pyrazol-5-ylsulfonyl)-2-[4-(trifluoromethyl)piperidin-1-yl]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-(2-methylpiperidin-1-yl)pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-(7-oxa-1-azaspiro[4.4]nonan-1-yl)pyridine-3-carboxamide;6-[3-fluoro-5-(2-methylpropoxy)phenyl]-N-(1H-pyrazol-5-ylsulfonyl)-2-[4-(trifluoromethyl)piperidin-1-yl]pyridine-3-carboxamide
PubChem CID159043721
Molecular FormulaC80H91F6N15O13S3
Molecular Weight1680.89 g/mol
Exact Mass1679.60
IUPAC NameN-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-(2-methylpiperidin-1-yl)pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-(7-oxa-1-azaspiro[4.4]nonan-1-yl)pyridine-3-carboxamide;6-[3-fluoro-5-(2-methylpropoxy)phenyl]-N-(1H-pyrazol-5-ylsulfonyl)-2-[4-(trifluoromethyl)piperidin-1-yl]pyridine-3-carboxamide
SMILESCC(C)COc1cc(F)cc(-c2ccc(C(=O)NS(=O)(=O)c3cccc(N)n3)c(N3CCCC34CCOC4)n2)c1.CC(C)COc1cc(F)cc(-c2ccc(C(=O)NS(=O)(=O)c3cccc(N)n3)c(N3CCCCC3C)n2)c1.CC(C)COc1cc(F)cc(-c2ccc(C(=O)NS(=O)(=O)c3ccn[nH]3)c(N3CCC(C(F)(F)F)CC3)n2)c1
InChIInChI=1S/C28H32FN5O5S.C27H32FN5O4S.C25H27F4N5O4S/c1-18(2)16-39-21-14-19(13-20(29)15-21)23-8-7-22(26(31-23)34-11-4-9-28(34)10-12-38-17-28)27(35)33-40(36,37)25-6-3-5-24(30)32-25;1-17(2)16-37-21-14-19(13-20(28)15-21)23-11-10-22(26(30-23)33-12-5-4-7-18(33)3)27(34)32-38(35,36)25-9-6-8-24(29)31-25;1-15(2)14-38-19-12-16(11-18(26)13-19)21-4-3-20(24(35)33-39(36,37)22-5-8-30-32-22)23(31-21)34-9-6-17(7-10-34)25(27,28)29/h3,5-8,13-15,18H,4,9-12,16-17H2,1-2H3,(H2,30,32)(H,33,35);6,8-11,13-15,17-18H,4-5,7,12,16H2,1-3H3,(H2,29,31)(H,32,34);3-5,8,11-13,15,17H,6-7,9-10,14H2,1-2H3,(H,30,32)(H,33,35)
InChIKeyJWJWNCLENAYSPE-UHFFFAOYSA-N
XLogP12.72
TPSA381.53 Ų
H-Bond Donors6
H-Bond Acceptors24
Rotatable Bonds24
Heavy Atoms117
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001680.89
LogP ≤ 512.72
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1024

Analyze N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-(2-methylpiperidin-1-yl)pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-(7-oxa-1-azaspiro[4.4]nonan-1-yl)pyridine-3-carboxamide;6-[3-fluoro-5-(2-methylpropoxy)phenyl]-N-(1H-pyrazol-5-ylsulfonyl)-2-[4-(trifluoromethyl)piperidin-1-yl]pyridine-3-carboxamide with MolForge

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Related Compounds

6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-(2-oxa-8-azaspiro[3.5]nonan-8-yl)-N-(1H-pyrazol-5-ylsulfonyl)pyridine-3-carboxamide
CID 121250542
2-(4-ethoxypiperidin-1-yl)-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-N-(1H-pyrazol-5-ylsulfonyl)pyridine-3-carboxamide
CID 121250556
6-[3-fluoro-5-(2-methylpropoxy)phenyl]-N-(1H-pyrazol-5-ylsulfonyl)-2-[[3-(trifluoromethyl)cyclohexyl]amino]pyridine-3-carboxamide
CID 121250654
2-(3-ethynylpiperidin-1-yl)-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-N-(1H-pyrazol-5-ylsulfonyl)pyridine-3-carboxamide
CID 121250701
2-(2,3-dimethylpiperidin-1-yl)-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-N-(1H-pyrazol-5-ylsulfonyl)pyridine-3-carboxamide
CID 121250719
6-[3-fluoro-5-(2-methylpropoxy)phenyl]-N-(1H-pyrazol-5-ylsulfonyl)-2-(2,2,3-trimethylpyrrolidin-1-yl)pyridine-3-carboxamide
CID 121250768
6-[3-fluoro-5-(2-methylpropoxy)phenyl]-N-(1H-pyrazol-5-ylsulfonyl)-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide
CID 121250786
2-(7-azaspiro[3.5]nonan-7-yl)-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-N-(1H-pyrazol-5-ylsulfonyl)pyridine-3-carboxamide
CID 121250865
6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-(4-propan-2-ylpiperidin-1-yl)-N-(1H-pyrazol-5-ylsulfonyl)pyridine-3-carboxamide
CID 121250966
6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-[3-(methoxymethyl)piperidin-1-yl]-N-(1H-pyrazol-5-ylsulfonyl)pyridine-3-carboxamide
CID 121250968
6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-[(2S)-2-phenylpyrrolidin-1-yl]-N-(1H-pyrazol-5-ylsulfonyl)pyridine-3-carboxamide
CID 121251011
2-[(2S,5R)-2,5-dimethylpyrrolidin-1-yl]-6-(3-fluoro-5-propan-2-yloxyphenyl)-N-(1H-pyrazol-5-ylsulfonyl)pyridine-3-carboxamide
CID 121251096

Frequently Asked Questions

What is the IUPAC name of N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-(2-methylpiperidin-1-yl)pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-(7-oxa-1-azaspiro[4.4]nonan-1-yl)pyridine-3-carboxamide;6-[3-fluoro-5-(2-methylpropoxy)phenyl]-N-(1H-pyrazol-5-ylsulfonyl)-2-[4-(trifluoromethyl)piperidin-1-yl]pyridine-3-carboxamide?
The IUPAC name of N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-(2-methylpiperidin-1-yl)pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-(7-oxa-1-azaspiro[4.4]nonan-1-yl)pyridine-3-carboxamide;6-[3-fluoro-5-(2-methylpropoxy)phenyl]-N-(1H-pyrazol-5-ylsulfonyl)-2-[4-(trifluoromethyl)piperidin-1-yl]pyridine-3-carboxamide (CID 159043721) is N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-(2-methylpiperidin-1-yl)pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-(7-oxa-1-azaspiro[4.4]nonan-1-yl)pyridine-3-carboxamide;6-[3-fluoro-5-(2-methylpropoxy)phenyl]-N-(1H-pyrazol-5-ylsulfonyl)-2-[4-(trifluoromethyl)piperidin-1-yl]pyridine-3-carboxamide.
What is the SMILES notation for N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-(2-methylpiperidin-1-yl)pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-(7-oxa-1-azaspiro[4.4]nonan-1-yl)pyridine-3-carboxamide;6-[3-fluoro-5-(2-methylpropoxy)phenyl]-N-(1H-pyrazol-5-ylsulfonyl)-2-[4-(trifluoromethyl)piperidin-1-yl]pyridine-3-carboxamide?
The canonical SMILES for N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-(2-methylpiperidin-1-yl)pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-(7-oxa-1-azaspiro[4.4]nonan-1-yl)pyridine-3-carboxamide;6-[3-fluoro-5-(2-methylpropoxy)phenyl]-N-(1H-pyrazol-5-ylsulfonyl)-2-[4-(trifluoromethyl)piperidin-1-yl]pyridine-3-carboxamide is CC(C)COc1cc(F)cc(-c2ccc(C(=O)NS(=O)(=O)c3cccc(N)n3)c(N3CCCC34CCOC4)n2)c1.CC(C)COc1cc(F)cc(-c2ccc(C(=O)NS(=O)(=O)c3cccc(N)n3)c(N3CCCCC3C)n2)c1.CC(C)COc1cc(F)cc(-c2ccc(C(=O)NS(=O)(=O)c3ccn[nH]3)c(N3CCC(C(F)(F)F)CC3)n2)c1.
What is the InChIKey of N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-(2-methylpiperidin-1-yl)pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-(7-oxa-1-azaspiro[4.4]nonan-1-yl)pyridine-3-carboxamide;6-[3-fluoro-5-(2-methylpropoxy)phenyl]-N-(1H-pyrazol-5-ylsulfonyl)-2-[4-(trifluoromethyl)piperidin-1-yl]pyridine-3-carboxamide?
The InChIKey is JWJWNCLENAYSPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H32FN5O5S.C27H32FN5O4S.C25H27F4N5O4S/c1-18(2)16-39-21-14-19(13-20(29)15-21)23-8-7-22(26(31-23)34-11-4-9-28(34)10-12-38-17-28)27(35)33-40(36,37)25-6-3-5-24(30)32-25;1-17(2)16-37-21-14-19(13-20(28)15-21)23-11-10-22(26(30-23)33-12-5-4-7-18(33)3)27(34)32-38(35,36)25-9-6-8-24(29)31-25;1-15(2)14-38-19-12-16(11-18(26)13-19)21-4-3-20(24(35)33-39(36,37)22-5-8-30-32-22)23(31-21)34-9-6-17(7-10-34)25(27,28)29/h3,5-8,13-15,18H,4,9-12,16-17H2,1-2H3,(H2,30,32)(H,33,35);6,8-11,13-15,17-18H,4-5,7,12,16H2,1-3H3,(H2,29,31)(H,32,34);3-5,8,11-13,15,17H,6-7,9-10,14H2,1-2H3,(H,30,32)(H,33,35).
What are the key properties of N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-(2-methylpiperidin-1-yl)pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-(7-oxa-1-azaspiro[4.4]nonan-1-yl)pyridine-3-carboxamide;6-[3-fluoro-5-(2-methylpropoxy)phenyl]-N-(1H-pyrazol-5-ylsulfonyl)-2-[4-(trifluoromethyl)piperidin-1-yl]pyridine-3-carboxamide?
N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-(2-methylpiperidin-1-yl)pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-(7-oxa-1-azaspiro[4.4]nonan-1-yl)pyridine-3-carboxamide;6-[3-fluoro-5-(2-methylpropoxy)phenyl]-N-(1H-pyrazol-5-ylsulfonyl)-2-[4-(trifluoromethyl)piperidin-1-yl]pyridine-3-carboxamide has a molecular weight of 1680.89 g/mol, XLogP of 12.72, 24 rotatable bonds, 6 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-(2-methylpiperidin-1-yl)pyridine-3-carboxamide;N-[(6-amino-2-pyridinyl)sulfonyl]-6-[3-fluoro-5-(2-methylpropoxy)phenyl]-2-(7-oxa-1-azaspiro[4.4]nonan-1-yl)pyridine-3-carboxamide;6-[3-fluoro-5-(2-methylpropoxy)phenyl]-N-(1H-pyrazol-5-ylsulfonyl)-2-[4-(trifluoromethyl)piperidin-1-yl]pyridine-3-carboxamide is sourced from PubChem (CID 159043721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).