N-(3-amino-4-pyridinyl)-N,3,5-trimethyl-1H-pyrazole-4-sulfonamide

C11H15N5O2S — CID 61358245

IUPACN-(3-amino-4-pyridinyl)-N,3,5-trimethyl-1H-pyrazole-4-sulfonamide
SMILESCc1n[nH]c(C)c1S(=O)(=O)N(C)c1ccncc1N
InChIInChI=1S/C11H15N5O2S/c1-7-11(8(2)15-14-7)19(17,18)16(3)10-4-5-13-6-9(10)12/h4-6H,12H2,1-3H3,(H,14,15)
InChIKeyCMCFARPPBXQDCP-UHFFFAOYSA-N
MW281.34 g/mol
LogP0.83
Rot. Bonds3

About N-(3-amino-4-pyridinyl)-N,3,5-trimethyl-1H-pyrazole-4-sulfonamide

N-(3-amino-4-pyridinyl)-N,3,5-trimethyl-1H-pyrazole-4-sulfonamide (PubChem CID 61358245) has the molecular formula C11H15N5O2S and a molecular weight of 281.34 g/mol. Its IUPAC name is N-(3-amino-4-pyridinyl)-N,3,5-trimethyl-1H-pyrazole-4-sulfonamide.

Molecular Properties

Compound NameN-(3-amino-4-pyridinyl)-N,3,5-trimethyl-1H-pyrazole-4-sulfonamide
PubChem CID61358245
Molecular FormulaC11H15N5O2S
Molecular Weight281.34 g/mol
Exact Mass281.09
IUPAC NameN-(3-amino-4-pyridinyl)-N,3,5-trimethyl-1H-pyrazole-4-sulfonamide
SMILESCc1n[nH]c(C)c1S(=O)(=O)N(C)c1ccncc1N
InChIInChI=1S/C11H15N5O2S/c1-7-11(8(2)15-14-7)19(17,18)16(3)10-4-5-13-6-9(10)12/h4-6H,12H2,1-3H3,(H,14,15)
InChIKeyCMCFARPPBXQDCP-UHFFFAOYSA-N
XLogP0.83
TPSA104.97 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.34
LogP ≤ 50.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3-amino-4-pyridinyl)-N,2,5-trimethylbenzenesulfonamide
CID 61359410
3-amino-4-[methyl(sulfamoyl)amino]pyridine
CID 114958702
2-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonyl-methylamino]benzamide
CID 17436993
N-(3-amino-4-pyridinyl)-5-fluoro-N,2-dimethylbenzenesulfonamide
CID 61360190
N-(3-amino-4-pyridinyl)-2-bromo-N-methylbenzenesulfonamide
CID 61360192
N-(3-amino-4-pyridinyl)-1,1-difluoro-N-methylmethanesulfonamide
CID 61358244
N-(2-aminophenyl)-N-ethyl-3,5-dimethyl-1H-pyrazole-4-sulfonamide
CID 62100660
N-(2-aminophenyl)-3,5-dimethyl-N-propyl-1H-pyrazole-4-sulfonamide
CID 63230617
N,3,5-trimethyl-N-(4-nitrophenyl)-1H-pyrazole-4-sulfonamide
CID 43348964
N-[4-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonyl-methylamino]phenyl]acetamide
CID 113095048
4-N,4-N-dimethylpyridine-3,4-diamine
CID 14088946
N-(3-amino-4-pyridinyl)-N,3-dimethylbutane-1-sulfonamide
CID 63856219

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-4-pyridinyl)-N,3,5-trimethyl-1H-pyrazole-4-sulfonamide?
The IUPAC name of N-(3-amino-4-pyridinyl)-N,3,5-trimethyl-1H-pyrazole-4-sulfonamide (CID 61358245) is N-(3-amino-4-pyridinyl)-N,3,5-trimethyl-1H-pyrazole-4-sulfonamide.
What is the SMILES notation for N-(3-amino-4-pyridinyl)-N,3,5-trimethyl-1H-pyrazole-4-sulfonamide?
The canonical SMILES for N-(3-amino-4-pyridinyl)-N,3,5-trimethyl-1H-pyrazole-4-sulfonamide is Cc1n[nH]c(C)c1S(=O)(=O)N(C)c1ccncc1N.
What is the InChIKey of N-(3-amino-4-pyridinyl)-N,3,5-trimethyl-1H-pyrazole-4-sulfonamide?
The InChIKey is CMCFARPPBXQDCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5O2S/c1-7-11(8(2)15-14-7)19(17,18)16(3)10-4-5-13-6-9(10)12/h4-6H,12H2,1-3H3,(H,14,15).
What are the key properties of N-(3-amino-4-pyridinyl)-N,3,5-trimethyl-1H-pyrazole-4-sulfonamide?
N-(3-amino-4-pyridinyl)-N,3,5-trimethyl-1H-pyrazole-4-sulfonamide has a molecular weight of 281.34 g/mol, XLogP of 0.83, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-4-pyridinyl)-N,3,5-trimethyl-1H-pyrazole-4-sulfonamide is sourced from PubChem (CID 61358245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).