N-(1,5-dimethylpyrazol-4-yl)-4-[(1,5-dimethylpyrazol-4-yl)sulfonylamino]-1-methylpyrazole-5-carboxamide

C15H20N8O3S — CID 17022672

IUPACN-(1,5-dimethylpyrazol-4-yl)-4-[(1,5-dimethylpyrazol-4-yl)sulfonylamino]-1-methylpyrazole-5-carboxamide
SMILESCc1c(NC(=O)c2c(NS(=O)(=O)c3cnn(C)c3C)cnn2C)cnn1C
InChIInChI=1S/C15H20N8O3S/c1-9-11(6-16-21(9)3)19-15(24)14-12(7-17-23(14)5)20-27(25,26)13-8-18-22(4)10(13)2/h6-8,20H,1-5H3,(H,19,24)
InChIKeyPMXGEUFSVKTWSF-UHFFFAOYSA-N
MW392.45 g/mol
LogP0.56
Rot. Bonds5

About N-(1,5-dimethylpyrazol-4-yl)-4-[(1,5-dimethylpyrazol-4-yl)sulfonylamino]-1-methylpyrazole-5-carboxamide

N-(1,5-dimethylpyrazol-4-yl)-4-[(1,5-dimethylpyrazol-4-yl)sulfonylamino]-1-methylpyrazole-5-carboxamide (PubChem CID 17022672) has the molecular formula C15H20N8O3S and a molecular weight of 392.45 g/mol. Its IUPAC name is N-(1,5-dimethylpyrazol-4-yl)-4-[(1,5-dimethylpyrazol-4-yl)sulfonylamino]-1-methylpyrazole-5-carboxamide.

Molecular Properties

Compound NameN-(1,5-dimethylpyrazol-4-yl)-4-[(1,5-dimethylpyrazol-4-yl)sulfonylamino]-1-methylpyrazole-5-carboxamide
PubChem CID17022672
Molecular FormulaC15H20N8O3S
Molecular Weight392.45 g/mol
Exact Mass392.14
IUPAC NameN-(1,5-dimethylpyrazol-4-yl)-4-[(1,5-dimethylpyrazol-4-yl)sulfonylamino]-1-methylpyrazole-5-carboxamide
SMILESCc1c(NC(=O)c2c(NS(=O)(=O)c3cnn(C)c3C)cnn2C)cnn1C
InChIInChI=1S/C15H20N8O3S/c1-9-11(6-16-21(9)3)19-15(24)14-12(7-17-23(14)5)20-27(25,26)13-8-18-22(4)10(13)2/h6-8,20H,1-5H3,(H,19,24)
InChIKeyPMXGEUFSVKTWSF-UHFFFAOYSA-N
XLogP0.56
TPSA128.73 Ų
H-Bond Donors2
H-Bond Acceptors9
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.45
LogP ≤ 50.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 109

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Related Compounds

4-amino-N-(1,5-dimethylpyrazol-4-yl)-1-methylpyrazole-5-carboxamide
CID 7017546
5-[(1,5-dimethylpyrazol-4-yl)carbamoyl]-1-methylpyrazole-4-carboxylic acid
CID 19494189
4-[(1,5-dimethylpyrazol-4-yl)sulfonylamino]-N,1-dimethylpyrazole-3-carboxamide
CID 19582232
N-(1,5-dimethylpyrazol-4-yl)-1-methyl-4-[(3-methylbenzoyl)amino]pyrazole-5-carboxamide
CID 19411137
N-(1,5-dimethylpyrazol-4-yl)acetamide
CID 19399796
4-[3-(benzenesulfonyl)propanoylamino]-N-(1,5-dimethylpyrazol-4-yl)-1-methylpyrazole-5-carboxamide
CID 19585255
4-[(3,5-dimethoxybenzoyl)amino]-N-(1,5-dimethylpyrazol-4-yl)-1-methylpyrazole-5-carboxamide
CID 19336622
N-(2,6-dimethylphenyl)-1,5-dimethylpyrazole-4-sulfonamide
CID 22773725
N-[3-[(1,5-dimethylpyrazol-4-yl)sulfonylamino]phenyl]acetamide
CID 22202614
tert-butyl N-(1,5-dimethylpyrazol-4-yl)carbamate
CID 67304447
N-(1,5-dimethylpyrazol-4-yl)-2,4,5-trimethylbenzamide
CID 134707317
N-(4-fluoro-2-methylphenyl)-1,5-dimethylpyrazole-4-sulfonamide
CID 22203197

Frequently Asked Questions

What is the IUPAC name of N-(1,5-dimethylpyrazol-4-yl)-4-[(1,5-dimethylpyrazol-4-yl)sulfonylamino]-1-methylpyrazole-5-carboxamide?
The IUPAC name of N-(1,5-dimethylpyrazol-4-yl)-4-[(1,5-dimethylpyrazol-4-yl)sulfonylamino]-1-methylpyrazole-5-carboxamide (CID 17022672) is N-(1,5-dimethylpyrazol-4-yl)-4-[(1,5-dimethylpyrazol-4-yl)sulfonylamino]-1-methylpyrazole-5-carboxamide.
What is the SMILES notation for N-(1,5-dimethylpyrazol-4-yl)-4-[(1,5-dimethylpyrazol-4-yl)sulfonylamino]-1-methylpyrazole-5-carboxamide?
The canonical SMILES for N-(1,5-dimethylpyrazol-4-yl)-4-[(1,5-dimethylpyrazol-4-yl)sulfonylamino]-1-methylpyrazole-5-carboxamide is Cc1c(NC(=O)c2c(NS(=O)(=O)c3cnn(C)c3C)cnn2C)cnn1C.
What is the InChIKey of N-(1,5-dimethylpyrazol-4-yl)-4-[(1,5-dimethylpyrazol-4-yl)sulfonylamino]-1-methylpyrazole-5-carboxamide?
The InChIKey is PMXGEUFSVKTWSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N8O3S/c1-9-11(6-16-21(9)3)19-15(24)14-12(7-17-23(14)5)20-27(25,26)13-8-18-22(4)10(13)2/h6-8,20H,1-5H3,(H,19,24).
What are the key properties of N-(1,5-dimethylpyrazol-4-yl)-4-[(1,5-dimethylpyrazol-4-yl)sulfonylamino]-1-methylpyrazole-5-carboxamide?
N-(1,5-dimethylpyrazol-4-yl)-4-[(1,5-dimethylpyrazol-4-yl)sulfonylamino]-1-methylpyrazole-5-carboxamide has a molecular weight of 392.45 g/mol, XLogP of 0.56, 5 rotatable bonds, 2 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,5-dimethylpyrazol-4-yl)-4-[(1,5-dimethylpyrazol-4-yl)sulfonylamino]-1-methylpyrazole-5-carboxamide is sourced from PubChem (CID 17022672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).