carbanide;ethane;4-methyl-N-[4-methyl-2-(3-methyl-1-oxidopyridin-1-ium-2-carbonyl)phenyl]benzenesulfonamide;4-methyl-N-[4-methyl-2-(2-methylpyridine-3-carbonyl)phenyl]benzenesulfonamide;4-methyl-N-[4-methyl-2-(6-methylpyridine-3-carbonyl)phenyl]benzenesulfonamide;N-[2-(1-oxidopyridin-1-ium-3-carbonyl)phenyl]benzenesulfonamide;N-[2-(pyridine-3-carbonyl)phenyl]benzenesulfonamide;ytterbium

C139H208N10O17S5Yb2-2 — CID 159845396

IUPACcarbanide;ethane;4-methyl-N-[4-methyl-2-(3-methyl-1-oxidopyridin-1-ium-2-carbonyl)phenyl]benzenesulfonamide;4-methyl-N-[4-methyl-2-(2-methylpyridine-3-carbonyl)phenyl]benzenesulfonamide;4-methyl-N-[4-methyl-2-(6-methylpyridine-3-carbonyl)phenyl]benzenesulfonamide;N-[2-(1-oxidopyridin-1-ium-3-carbonyl)phenyl]benzenesulfonamide;N-[2-(pyridine-3-carbonyl)phenyl]benzenesulfonamide;ytterbium
SMILESCC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.Cc1ccc(S(=O)(=O)Nc2ccc(C)cc2C(=O)c2c(C)ccc[n+]2[O-])cc1.Cc1ccc(S(=O)(=O)Nc2ccc(C)cc2C(=O)c2ccc(C)nc2)cc1.Cc1ccc(S(=O)(=O)Nc2ccc(C)cc2C(=O)c2cccnc2C)cc1.O=C(c1ccc[n+]([O-])c1)c1ccccc1NS(=O)(=O)c1ccccc1.O=C(c1cccnc1)c1ccccc1NS(=O)(=O)c1ccccc1.[CH3-].[CH3-].[Yb].[Yb]
InChIInChI=1S/C21H20N2O4S.2C21H20N2O3S.C18H14N2O4S.C18H14N2O3S.19C2H6.2CH3.2Yb/c1-14-6-9-17(10-7-14)28(26,27)22-19-11-8-15(2)13-18(19)21(24)20-16(3)5-4-12-23(20)25;1-14-4-9-18(10-5-14)27(25,26)23-20-11-6-15(2)12-19(20)21(24)17-8-7-16(3)22-13-17;1-14-6-9-17(10-7-14)27(25,26)23-20-11-8-15(2)13-19(20)21(24)18-5-4-12-22-16(18)3;21-18(14-7-6-12-20(22)13-14)16-10-4-5-11-17(16)19-25(23,24)15-8-2-1-3-9-15;21-18(14-7-6-12-19-13-14)16-10-4-5-11-17(16)20-24(22,23)15-8-2-1-3-9-15;19*1-2;;;;/h4-13,22H,1-3H3;2*4-13,23H,1-3H3;1-13,19H;1-13,20H;19*1-2H3;2*1H3;;/q;;;;;;;;;;;;;;;;;;;;;;;;2*-1;;
InChIKeyZCVLKUMEYCVVHV-UHFFFAOYSA-N
MW2797.66 g/mol
LogP37.22
Rot. Bonds25

About carbanide;ethane;4-methyl-N-[4-methyl-2-(3-methyl-1-oxidopyridin-1-ium-2-carbonyl)phenyl]benzenesulfonamide;4-methyl-N-[4-methyl-2-(2-methylpyridine-3-carbonyl)phenyl]benzenesulfonamide;4-methyl-N-[4-methyl-2-(6-methylpyridine-3-carbonyl)phenyl]benzenesulfonamide;N-[2-(1-oxidopyridin-1-ium-3-carbonyl)phenyl]benzenesulfonamide;N-[2-(pyridine-3-carbonyl)phenyl]benzenesulfonamide;ytterbium

carbanide;ethane;4-methyl-N-[4-methyl-2-(3-methyl-1-oxidopyridin-1-ium-2-carbonyl)phenyl]benzenesulfonamide;4-methyl-N-[4-methyl-2-(2-methylpyridine-3-carbonyl)phenyl]benzenesulfonamide;4-methyl-N-[4-methyl-2-(6-methylpyridine-3-carbonyl)phenyl]benzenesulfonamide;N-[2-(1-oxidopyridin-1-ium-3-carbonyl)phenyl]benzenesulfonamide;N-[2-(pyridine-3-carbonyl)phenyl]benzenesulfonamide;ytterbium (PubChem CID 159845396) has the molecular formula C139H208N10O17S5Yb2-2 and a molecular weight of 2797.66 g/mol. Its IUPAC name is carbanide;ethane;4-methyl-N-[4-methyl-2-(3-methyl-1-oxidopyridin-1-ium-2-carbonyl)phenyl]benzenesulfonamide;4-methyl-N-[4-methyl-2-(2-methylpyridine-3-carbonyl)phenyl]benzenesulfonamide;4-methyl-N-[4-methyl-2-(6-methylpyridine-3-carbonyl)phenyl]benzenesulfonamide;N-[2-(1-oxidopyridin-1-ium-3-carbonyl)phenyl]benzenesulfonamide;N-[2-(pyridine-3-carbonyl)phenyl]benzenesulfonamide;ytterbium.

Molecular Properties

Compound Namecarbanide;ethane;4-methyl-N-[4-methyl-2-(3-methyl-1-oxidopyridin-1-ium-2-carbonyl)phenyl]benzenesulfonamide;4-methyl-N-[4-methyl-2-(2-methylpyridine-3-carbonyl)phenyl]benzenesulfonamide;4-methyl-N-[4-methyl-2-(6-methylpyridine-3-carbonyl)phenyl]benzenesulfonamide;N-[2-(1-oxidopyridin-1-ium-3-carbonyl)phenyl]benzenesulfonamide;N-[2-(pyridine-3-carbonyl)phenyl]benzenesulfonamide;ytterbium
PubChem CID159845396
Molecular FormulaC139H208N10O17S5Yb2-2
Molecular Weight2797.66 g/mol
Exact Mass2797.31
IUPAC Namecarbanide;ethane;4-methyl-N-[4-methyl-2-(3-methyl-1-oxidopyridin-1-ium-2-carbonyl)phenyl]benzenesulfonamide;4-methyl-N-[4-methyl-2-(2-methylpyridine-3-carbonyl)phenyl]benzenesulfonamide;4-methyl-N-[4-methyl-2-(6-methylpyridine-3-carbonyl)phenyl]benzenesulfonamide;N-[2-(1-oxidopyridin-1-ium-3-carbonyl)phenyl]benzenesulfonamide;N-[2-(pyridine-3-carbonyl)phenyl]benzenesulfonamide;ytterbium
SMILESCC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.Cc1ccc(S(=O)(=O)Nc2ccc(C)cc2C(=O)c2c(C)ccc[n+]2[O-])cc1.Cc1ccc(S(=O)(=O)Nc2ccc(C)cc2C(=O)c2ccc(C)nc2)cc1.Cc1ccc(S(=O)(=O)Nc2ccc(C)cc2C(=O)c2cccnc2C)cc1.O=C(c1ccc[n+]([O-])c1)c1ccccc1NS(=O)(=O)c1ccccc1.O=C(c1cccnc1)c1ccccc1NS(=O)(=O)c1ccccc1.[CH3-].[CH3-].[Yb].[Yb]
InChIInChI=1S/C21H20N2O4S.2C21H20N2O3S.C18H14N2O4S.C18H14N2O3S.19C2H6.2CH3.2Yb/c1-14-6-9-17(10-7-14)28(26,27)22-19-11-8-15(2)13-18(19)21(24)20-16(3)5-4-12-23(20)25;1-14-4-9-18(10-5-14)27(25,26)23-20-11-6-15(2)12-19(20)21(24)17-8-7-16(3)22-13-17;1-14-6-9-17(10-7-14)27(25,26)23-20-11-8-15(2)13-19(20)21(24)18-5-4-12-22-16(18)3;21-18(14-7-6-12-20(22)13-14)16-10-4-5-11-17(16)19-25(23,24)15-8-2-1-3-9-15;21-18(14-7-6-12-19-13-14)16-10-4-5-11-17(16)20-24(22,23)15-8-2-1-3-9-15;19*1-2;;;;/h4-13,22H,1-3H3;2*4-13,23H,1-3H3;1-13,19H;1-13,20H;19*1-2H3;2*1H3;;/q;;;;;;;;;;;;;;;;;;;;;;;;2*-1;;
InChIKeyZCVLKUMEYCVVHV-UHFFFAOYSA-N
XLogP37.22
TPSA408.75 Ų
H-Bond Donors5
H-Bond Acceptors20
Rotatable Bonds25
Heavy Atoms173
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002797.66
LogP ≤ 537.22
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1020

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anthranil_one_A(38)', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'N_oxide', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}

Analyze carbanide;ethane;4-methyl-N-[4-methyl-2-(3-methyl-1-oxidopyridin-1-ium-2-carbonyl)phenyl]benzenesulfonamide;4-methyl-N-[4-methyl-2-(2-methylpyridine-3-carbonyl)phenyl]benzenesulfonamide;4-methyl-N-[4-methyl-2-(6-methylpyridine-3-carbonyl)phenyl]benzenesulfonamide;N-[2-(1-oxidopyridin-1-ium-3-carbonyl)phenyl]benzenesulfonamide;N-[2-(pyridine-3-carbonyl)phenyl]benzenesulfonamide;ytterbium with MolForge

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Related Compounds

4-methyl-N-[4-methyl-2-(3-methyl-1-oxidopyridin-1-ium-2-carbonyl)phenyl]benzenesulfonamide
CID 59788588
4-methyl-N-[4-methyl-2-(1-oxidopyridin-1-ium-2-carbonyl)phenyl]benzenesulfonamide
CID 59788620
4-methyl-N-[4-methyl-2-(2-methyl-1-oxidopyridin-1-ium-3-carbonyl)phenyl]benzenesulfonamide
CID 59788760
4-methyl-N-[4-methyl-2-(6-methyl-1-oxidopyridin-1-ium-3-carbonyl)phenyl]benzenesulfonamide
CID 59788773
ethane;4-methyl-N-[4-methyl-2-(1-oxidopyridin-1-ium-2-carbonyl)phenyl]benzenesulfonamide
CID 91032505
ethane;4-methyl-N-[4-methyl-2-(2-methyl-1-oxidopyridin-1-ium-3-carbonyl)phenyl]benzenesulfonamide
CID 91068893
ethane;4-methyl-N-[4-methyl-2-(6-methyl-1-oxidopyridin-1-ium-3-carbonyl)phenyl]benzenesulfonamide
CID 91134665
ethane;4-methyl-N-[4-methyl-2-(3-methyl-1-oxidopyridin-1-ium-2-carbonyl)phenyl]benzenesulfonamide
CID 91388583
carbanide;ethane;4-methyl-N-[4-methyl-2-(3-methyl-1-oxidopyridin-1-ium-2-carbonyl)phenyl]benzenesulfonamide;4-methyl-N-[4-methyl-2-(3-methylpyridine-2-carbonyl)phenyl]benzenesulfonamide;4-methyl-N-[4-methyl-2-(6-methylpyridine-2-carbonyl)phenyl]benzenesulfonamide;N-[2-(1-oxidopyridin-1-ium-2-carbonyl)phenyl]benzenesulfonamide;N-[2-(pyridine-2-carbonyl)phenyl]benzenesulfonamide;ytterbium
CID 157705527
N-[4,5-dimethyl-2-(3-methyl-1-oxidopyridin-1-ium-2-carbonyl)phenyl]-4-methylbenzenesulfonamide;N-[4,5-dimethyl-2-(6-methyl-1-oxidopyridin-1-ium-2-carbonyl)phenyl]-4-methylbenzenesulfonamide;N-[4,5-dimethyl-2-(2-methylpyridine-3-carbonyl)phenyl]-4-methylbenzenesulfonamide;N-[4,5-dimethyl-2-(pyridine-3-carbonyl)phenyl]benzenesulfonamide;ethane
CID 157941714
N-[4,5-dimethyl-2-(2-methyl-1-oxidopyridin-1-ium-3-carbonyl)phenyl]-4-methylbenzenesulfonamide;N-[4,5-dimethyl-2-(6-methyl-1-oxidopyridin-1-ium-3-carbonyl)phenyl]-4-methylbenzenesulfonamide;N-[4,5-dimethyl-2-(6-methylpyridine-3-carbonyl)phenyl]-4-methylbenzenesulfonamide;N-[4,5-dimethyl-2-(1-oxidopyridin-1-ium-3-carbonyl)phenyl]benzenesulfonamide;ethane
CID 158372476
N-[4,5-dimethyl-2-(2-methyl-1-oxidopyridin-1-ium-3-carbonyl)phenyl]-4-methylbenzenesulfonamide;N-[4,5-dimethyl-2-(6-methyl-1-oxidopyridin-1-ium-3-carbonyl)phenyl]-4-methylbenzenesulfonamide;N-[4,5-dimethyl-2-(2-methylpyridine-4-carbonyl)phenyl]-4-methylbenzenesulfonamide;N-[4,5-dimethyl-2-(pyridine-4-carbonyl)phenyl]benzenesulfonamide;ethane
CID 158619495

Frequently Asked Questions

What is the IUPAC name of carbanide;ethane;4-methyl-N-[4-methyl-2-(3-methyl-1-oxidopyridin-1-ium-2-carbonyl)phenyl]benzenesulfonamide;4-methyl-N-[4-methyl-2-(2-methylpyridine-3-carbonyl)phenyl]benzenesulfonamide;4-methyl-N-[4-methyl-2-(6-methylpyridine-3-carbonyl)phenyl]benzenesulfonamide;N-[2-(1-oxidopyridin-1-ium-3-carbonyl)phenyl]benzenesulfonamide;N-[2-(pyridine-3-carbonyl)phenyl]benzenesulfonamide;ytterbium?
The IUPAC name of carbanide;ethane;4-methyl-N-[4-methyl-2-(3-methyl-1-oxidopyridin-1-ium-2-carbonyl)phenyl]benzenesulfonamide;4-methyl-N-[4-methyl-2-(2-methylpyridine-3-carbonyl)phenyl]benzenesulfonamide;4-methyl-N-[4-methyl-2-(6-methylpyridine-3-carbonyl)phenyl]benzenesulfonamide;N-[2-(1-oxidopyridin-1-ium-3-carbonyl)phenyl]benzenesulfonamide;N-[2-(pyridine-3-carbonyl)phenyl]benzenesulfonamide;ytterbium (CID 159845396) is carbanide;ethane;4-methyl-N-[4-methyl-2-(3-methyl-1-oxidopyridin-1-ium-2-carbonyl)phenyl]benzenesulfonamide;4-methyl-N-[4-methyl-2-(2-methylpyridine-3-carbonyl)phenyl]benzenesulfonamide;4-methyl-N-[4-methyl-2-(6-methylpyridine-3-carbonyl)phenyl]benzenesulfonamide;N-[2-(1-oxidopyridin-1-ium-3-carbonyl)phenyl]benzenesulfonamide;N-[2-(pyridine-3-carbonyl)phenyl]benzenesulfonamide;ytterbium.
What is the SMILES notation for carbanide;ethane;4-methyl-N-[4-methyl-2-(3-methyl-1-oxidopyridin-1-ium-2-carbonyl)phenyl]benzenesulfonamide;4-methyl-N-[4-methyl-2-(2-methylpyridine-3-carbonyl)phenyl]benzenesulfonamide;4-methyl-N-[4-methyl-2-(6-methylpyridine-3-carbonyl)phenyl]benzenesulfonamide;N-[2-(1-oxidopyridin-1-ium-3-carbonyl)phenyl]benzenesulfonamide;N-[2-(pyridine-3-carbonyl)phenyl]benzenesulfonamide;ytterbium?
The canonical SMILES for carbanide;ethane;4-methyl-N-[4-methyl-2-(3-methyl-1-oxidopyridin-1-ium-2-carbonyl)phenyl]benzenesulfonamide;4-methyl-N-[4-methyl-2-(2-methylpyridine-3-carbonyl)phenyl]benzenesulfonamide;4-methyl-N-[4-methyl-2-(6-methylpyridine-3-carbonyl)phenyl]benzenesulfonamide;N-[2-(1-oxidopyridin-1-ium-3-carbonyl)phenyl]benzenesulfonamide;N-[2-(pyridine-3-carbonyl)phenyl]benzenesulfonamide;ytterbium is CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.Cc1ccc(S(=O)(=O)Nc2ccc(C)cc2C(=O)c2c(C)ccc[n+]2[O-])cc1.Cc1ccc(S(=O)(=O)Nc2ccc(C)cc2C(=O)c2ccc(C)nc2)cc1.Cc1ccc(S(=O)(=O)Nc2ccc(C)cc2C(=O)c2cccnc2C)cc1.O=C(c1ccc[n+]([O-])c1)c1ccccc1NS(=O)(=O)c1ccccc1.O=C(c1cccnc1)c1ccccc1NS(=O)(=O)c1ccccc1.[CH3-].[CH3-].[Yb].[Yb].
What is the InChIKey of carbanide;ethane;4-methyl-N-[4-methyl-2-(3-methyl-1-oxidopyridin-1-ium-2-carbonyl)phenyl]benzenesulfonamide;4-methyl-N-[4-methyl-2-(2-methylpyridine-3-carbonyl)phenyl]benzenesulfonamide;4-methyl-N-[4-methyl-2-(6-methylpyridine-3-carbonyl)phenyl]benzenesulfonamide;N-[2-(1-oxidopyridin-1-ium-3-carbonyl)phenyl]benzenesulfonamide;N-[2-(pyridine-3-carbonyl)phenyl]benzenesulfonamide;ytterbium?
The InChIKey is ZCVLKUMEYCVVHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N2O4S.2C21H20N2O3S.C18H14N2O4S.C18H14N2O3S.19C2H6.2CH3.2Yb/c1-14-6-9-17(10-7-14)28(26,27)22-19-11-8-15(2)13-18(19)21(24)20-16(3)5-4-12-23(20)25;1-14-4-9-18(10-5-14)27(25,26)23-20-11-6-15(2)12-19(20)21(24)17-8-7-16(3)22-13-17;1-14-6-9-17(10-7-14)27(25,26)23-20-11-8-15(2)13-19(20)21(24)18-5-4-12-22-16(18)3;21-18(14-7-6-12-20(22)13-14)16-10-4-5-11-17(16)19-25(23,24)15-8-2-1-3-9-15;21-18(14-7-6-12-19-13-14)16-10-4-5-11-17(16)20-24(22,23)15-8-2-1-3-9-15;19*1-2;;;;/h4-13,22H,1-3H3;2*4-13,23H,1-3H3;1-13,19H;1-13,20H;19*1-2H3;2*1H3;;/q;;;;;;;;;;;;;;;;;;;;;;;;2*-1;;.
What are the key properties of carbanide;ethane;4-methyl-N-[4-methyl-2-(3-methyl-1-oxidopyridin-1-ium-2-carbonyl)phenyl]benzenesulfonamide;4-methyl-N-[4-methyl-2-(2-methylpyridine-3-carbonyl)phenyl]benzenesulfonamide;4-methyl-N-[4-methyl-2-(6-methylpyridine-3-carbonyl)phenyl]benzenesulfonamide;N-[2-(1-oxidopyridin-1-ium-3-carbonyl)phenyl]benzenesulfonamide;N-[2-(pyridine-3-carbonyl)phenyl]benzenesulfonamide;ytterbium?
carbanide;ethane;4-methyl-N-[4-methyl-2-(3-methyl-1-oxidopyridin-1-ium-2-carbonyl)phenyl]benzenesulfonamide;4-methyl-N-[4-methyl-2-(2-methylpyridine-3-carbonyl)phenyl]benzenesulfonamide;4-methyl-N-[4-methyl-2-(6-methylpyridine-3-carbonyl)phenyl]benzenesulfonamide;N-[2-(1-oxidopyridin-1-ium-3-carbonyl)phenyl]benzenesulfonamide;N-[2-(pyridine-3-carbonyl)phenyl]benzenesulfonamide;ytterbium has a molecular weight of 2797.66 g/mol, XLogP of 37.22, 25 rotatable bonds, 5 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for carbanide;ethane;4-methyl-N-[4-methyl-2-(3-methyl-1-oxidopyridin-1-ium-2-carbonyl)phenyl]benzenesulfonamide;4-methyl-N-[4-methyl-2-(2-methylpyridine-3-carbonyl)phenyl]benzenesulfonamide;4-methyl-N-[4-methyl-2-(6-methylpyridine-3-carbonyl)phenyl]benzenesulfonamide;N-[2-(1-oxidopyridin-1-ium-3-carbonyl)phenyl]benzenesulfonamide;N-[2-(pyridine-3-carbonyl)phenyl]benzenesulfonamide;ytterbium is sourced from PubChem (CID 159845396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).