1-cyclopropyl-N-[4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]phenyl]methanesulfonamide;N-(methyl-methylidene-oxo-λ6-sulfanyl)-4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]aniline;N-propan-2-yl-4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]aniline;N-[4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]phenyl]cyclopropanesulfonamide;N-[4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]phenyl]propane-2-sulfonamide

C100H116N20O7S4 — CID 159058282

IUPAC1-cyclopropyl-N-[4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]phenyl]methanesulfonamide;N-(methyl-methylidene-oxo-λ6-sulfanyl)-4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]aniline;N-propan-2-yl-4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]aniline;N-[4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]phenyl]cyclopropanesulfonamide;N-[4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]phenyl]propane-2-sulfonamide
SMILESC=S(C)(=O)Nc1ccc(-c2cnn(-c3ccnc(CCC)c3)c2)cc1.CCCc1cc(-n2cc(-c3ccc(NC(C)C)cc3)cn2)ccn1.CCCc1cc(-n2cc(-c3ccc(NS(=O)(=O)C(C)C)cc3)cn2)ccn1.CCCc1cc(-n2cc(-c3ccc(NS(=O)(=O)C4CC4)cc3)cn2)ccn1.CCCc1cc(-n2cc(-c3ccc(NS(=O)(=O)CC4CC4)cc3)cn2)ccn1
InChIInChI=1S/C21H24N4O2S.C20H22N4O2S.C20H24N4O2S.C20H24N4.C19H22N4OS/c1-2-3-20-12-21(10-11-22-20)25-14-18(13-23-25)17-6-8-19(9-7-17)24-28(26,27)15-16-4-5-16;1-2-3-18-12-19(10-11-21-18)24-14-16(13-22-24)15-4-6-17(7-5-15)23-27(25,26)20-8-9-20;1-4-5-19-12-20(10-11-21-19)24-14-17(13-22-24)16-6-8-18(9-7-16)23-27(25,26)15(2)3;1-4-5-19-12-20(10-11-21-19)24-14-17(13-22-24)16-6-8-18(9-7-16)23-15(2)3;1-4-5-18-12-19(10-11-20-18)23-14-16(13-21-23)15-6-8-17(9-7-15)22-25(2,3)24/h6-14,16,24H,2-5,15H2,1H3;4-7,10-14,20,23H,2-3,8-9H2,1H3;6-15,23H,4-5H2,1-3H3;6-15,23H,4-5H2,1-3H3;6-14H,2,4-5H2,1,3H3,(H,22,24)
InChIKeyJYDFOFAPSIDONA-UHFFFAOYSA-N
MW1838.43 g/mol
LogP20.13
Rot. Bonds34

About 1-cyclopropyl-N-[4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]phenyl]methanesulfonamide;N-(methyl-methylidene-oxo-λ6-sulfanyl)-4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]aniline;N-propan-2-yl-4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]aniline;N-[4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]phenyl]cyclopropanesulfonamide;N-[4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]phenyl]propane-2-sulfonamide

1-cyclopropyl-N-[4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]phenyl]methanesulfonamide;N-(methyl-methylidene-oxo-λ6-sulfanyl)-4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]aniline;N-propan-2-yl-4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]aniline;N-[4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]phenyl]cyclopropanesulfonamide;N-[4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]phenyl]propane-2-sulfonamide (PubChem CID 159058282) has the molecular formula C100H116N20O7S4 and a molecular weight of 1838.43 g/mol. Its IUPAC name is 1-cyclopropyl-N-[4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]phenyl]methanesulfonamide;N-(methyl-methylidene-oxo-λ6-sulfanyl)-4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]aniline;N-propan-2-yl-4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]aniline;N-[4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]phenyl]cyclopropanesulfonamide;N-[4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]phenyl]propane-2-sulfonamide.

Molecular Properties

Compound Name1-cyclopropyl-N-[4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]phenyl]methanesulfonamide;N-(methyl-methylidene-oxo-λ6-sulfanyl)-4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]aniline;N-propan-2-yl-4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]aniline;N-[4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]phenyl]cyclopropanesulfonamide;N-[4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]phenyl]propane-2-sulfonamide
PubChem CID159058282
Molecular FormulaC100H116N20O7S4
Molecular Weight1838.43 g/mol
Exact Mass1836.82
IUPAC Name1-cyclopropyl-N-[4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]phenyl]methanesulfonamide;N-(methyl-methylidene-oxo-λ6-sulfanyl)-4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]aniline;N-propan-2-yl-4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]aniline;N-[4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]phenyl]cyclopropanesulfonamide;N-[4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]phenyl]propane-2-sulfonamide
SMILESC=S(C)(=O)Nc1ccc(-c2cnn(-c3ccnc(CCC)c3)c2)cc1.CCCc1cc(-n2cc(-c3ccc(NC(C)C)cc3)cn2)ccn1.CCCc1cc(-n2cc(-c3ccc(NS(=O)(=O)C(C)C)cc3)cn2)ccn1.CCCc1cc(-n2cc(-c3ccc(NS(=O)(=O)C4CC4)cc3)cn2)ccn1.CCCc1cc(-n2cc(-c3ccc(NS(=O)(=O)CC4CC4)cc3)cn2)ccn1
InChIInChI=1S/C21H24N4O2S.C20H22N4O2S.C20H24N4O2S.C20H24N4.C19H22N4OS/c1-2-3-20-12-21(10-11-22-20)25-14-18(13-23-25)17-6-8-19(9-7-17)24-28(26,27)15-16-4-5-16;1-2-3-18-12-19(10-11-21-18)24-14-16(13-22-24)15-4-6-17(7-5-15)23-27(25,26)20-8-9-20;1-4-5-19-12-20(10-11-21-19)24-14-17(13-22-24)16-6-8-18(9-7-16)23-27(25,26)15(2)3;1-4-5-19-12-20(10-11-21-19)24-14-17(13-22-24)16-6-8-18(9-7-16)23-15(2)3;1-4-5-18-12-19(10-11-20-18)23-14-16(13-21-23)15-6-8-17(9-7-15)22-25(2,3)24/h6-14,16,24H,2-5,15H2,1H3;4-7,10-14,20,23H,2-3,8-9H2,1H3;6-15,23H,4-5H2,1-3H3;6-15,23H,4-5H2,1-3H3;6-14H,2,4-5H2,1,3H3,(H,22,24)
InChIKeyJYDFOFAPSIDONA-UHFFFAOYSA-N
XLogP20.13
TPSA333.19 Ų
H-Bond Donors5
H-Bond Acceptors23
Rotatable Bonds34
Heavy Atoms131
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001838.43
LogP ≤ 520.13
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1023

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Thiocarbonyl_group', 'substructure': 'N/A'}

Analyze 1-cyclopropyl-N-[4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]phenyl]methanesulfonamide;N-(methyl-methylidene-oxo-λ6-sulfanyl)-4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]aniline;N-propan-2-yl-4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]aniline;N-[4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]phenyl]cyclopropanesulfonamide;N-[4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]phenyl]propane-2-sulfonamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N-[4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]phenyl]methanesulfonamide;N-(methyl-methylidene-oxo-λ6-sulfanyl)-4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]aniline;N-propan-2-yl-4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]aniline;N-[4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]phenyl]cyclopropanesulfonamide;N-[4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]phenyl]propane-2-sulfonamide?
The IUPAC name of 1-cyclopropyl-N-[4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]phenyl]methanesulfonamide;N-(methyl-methylidene-oxo-λ6-sulfanyl)-4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]aniline;N-propan-2-yl-4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]aniline;N-[4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]phenyl]cyclopropanesulfonamide;N-[4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]phenyl]propane-2-sulfonamide (CID 159058282) is 1-cyclopropyl-N-[4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]phenyl]methanesulfonamide;N-(methyl-methylidene-oxo-λ6-sulfanyl)-4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]aniline;N-propan-2-yl-4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]aniline;N-[4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]phenyl]cyclopropanesulfonamide;N-[4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]phenyl]propane-2-sulfonamide.
What is the SMILES notation for 1-cyclopropyl-N-[4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]phenyl]methanesulfonamide;N-(methyl-methylidene-oxo-λ6-sulfanyl)-4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]aniline;N-propan-2-yl-4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]aniline;N-[4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]phenyl]cyclopropanesulfonamide;N-[4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]phenyl]propane-2-sulfonamide?
The canonical SMILES for 1-cyclopropyl-N-[4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]phenyl]methanesulfonamide;N-(methyl-methylidene-oxo-λ6-sulfanyl)-4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]aniline;N-propan-2-yl-4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]aniline;N-[4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]phenyl]cyclopropanesulfonamide;N-[4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]phenyl]propane-2-sulfonamide is C=S(C)(=O)Nc1ccc(-c2cnn(-c3ccnc(CCC)c3)c2)cc1.CCCc1cc(-n2cc(-c3ccc(NC(C)C)cc3)cn2)ccn1.CCCc1cc(-n2cc(-c3ccc(NS(=O)(=O)C(C)C)cc3)cn2)ccn1.CCCc1cc(-n2cc(-c3ccc(NS(=O)(=O)C4CC4)cc3)cn2)ccn1.CCCc1cc(-n2cc(-c3ccc(NS(=O)(=O)CC4CC4)cc3)cn2)ccn1.
What is the InChIKey of 1-cyclopropyl-N-[4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]phenyl]methanesulfonamide;N-(methyl-methylidene-oxo-λ6-sulfanyl)-4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]aniline;N-propan-2-yl-4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]aniline;N-[4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]phenyl]cyclopropanesulfonamide;N-[4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]phenyl]propane-2-sulfonamide?
The InChIKey is JYDFOFAPSIDONA-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N4O2S.C20H22N4O2S.C20H24N4O2S.C20H24N4.C19H22N4OS/c1-2-3-20-12-21(10-11-22-20)25-14-18(13-23-25)17-6-8-19(9-7-17)24-28(26,27)15-16-4-5-16;1-2-3-18-12-19(10-11-21-18)24-14-16(13-22-24)15-4-6-17(7-5-15)23-27(25,26)20-8-9-20;1-4-5-19-12-20(10-11-21-19)24-14-17(13-22-24)16-6-8-18(9-7-16)23-27(25,26)15(2)3;1-4-5-19-12-20(10-11-21-19)24-14-17(13-22-24)16-6-8-18(9-7-16)23-15(2)3;1-4-5-18-12-19(10-11-20-18)23-14-16(13-21-23)15-6-8-17(9-7-15)22-25(2,3)24/h6-14,16,24H,2-5,15H2,1H3;4-7,10-14,20,23H,2-3,8-9H2,1H3;6-15,23H,4-5H2,1-3H3;6-15,23H,4-5H2,1-3H3;6-14H,2,4-5H2,1,3H3,(H,22,24).
What are the key properties of 1-cyclopropyl-N-[4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]phenyl]methanesulfonamide;N-(methyl-methylidene-oxo-λ6-sulfanyl)-4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]aniline;N-propan-2-yl-4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]aniline;N-[4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]phenyl]cyclopropanesulfonamide;N-[4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]phenyl]propane-2-sulfonamide?
1-cyclopropyl-N-[4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]phenyl]methanesulfonamide;N-(methyl-methylidene-oxo-λ6-sulfanyl)-4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]aniline;N-propan-2-yl-4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]aniline;N-[4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]phenyl]cyclopropanesulfonamide;N-[4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]phenyl]propane-2-sulfonamide has a molecular weight of 1838.43 g/mol, XLogP of 20.13, 34 rotatable bonds, 5 hydrogen bond donors, and 23 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-[4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]phenyl]methanesulfonamide;N-(methyl-methylidene-oxo-λ6-sulfanyl)-4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]aniline;N-propan-2-yl-4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]aniline;N-[4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]phenyl]cyclopropanesulfonamide;N-[4-[1-(2-propyl-4-pyridinyl)pyrazol-4-yl]phenyl]propane-2-sulfonamide is sourced from PubChem (CID 159058282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).