N-(3-amino-2-pyridinyl)-3,5-dimethyl-1H-pyrazole-4-sulfonamide

C10H13N5O2S — CID 113391851

IUPACN-(3-amino-2-pyridinyl)-3,5-dimethyl-1H-pyrazole-4-sulfonamide
SMILESCc1n[nH]c(C)c1S(=O)(=O)Nc1ncccc1N
InChIInChI=1S/C10H13N5O2S/c1-6-9(7(2)14-13-6)18(16,17)15-10-8(11)4-3-5-12-10/h3-5H,11H2,1-2H3,(H,12,15)(H,13,14)
InChIKeyDTGIBVRWRYXRJX-UHFFFAOYSA-N
MW267.31 g/mol
LogP0.80
Rot. Bonds3

About N-(3-amino-2-pyridinyl)-3,5-dimethyl-1H-pyrazole-4-sulfonamide

N-(3-amino-2-pyridinyl)-3,5-dimethyl-1H-pyrazole-4-sulfonamide (PubChem CID 113391851) has the molecular formula C10H13N5O2S and a molecular weight of 267.31 g/mol. Its IUPAC name is N-(3-amino-2-pyridinyl)-3,5-dimethyl-1H-pyrazole-4-sulfonamide.

Molecular Properties

Compound NameN-(3-amino-2-pyridinyl)-3,5-dimethyl-1H-pyrazole-4-sulfonamide
PubChem CID113391851
Molecular FormulaC10H13N5O2S
Molecular Weight267.31 g/mol
Exact Mass267.08
IUPAC NameN-(3-amino-2-pyridinyl)-3,5-dimethyl-1H-pyrazole-4-sulfonamide
SMILESCc1n[nH]c(C)c1S(=O)(=O)Nc1ncccc1N
InChIInChI=1S/C10H13N5O2S/c1-6-9(7(2)14-13-6)18(16,17)15-10-8(11)4-3-5-12-10/h3-5H,11H2,1-2H3,(H,12,15)(H,13,14)
InChIKeyDTGIBVRWRYXRJX-UHFFFAOYSA-N
XLogP0.80
TPSA113.76 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.31
LogP ≤ 50.80
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-amino-6-chlorophenyl)-3,5-dimethyl-1H-pyrazole-4-sulfonamide
CID 62084614
N-(3-amino-2-pyridinyl)-1H-pyrazole-5-sulfonamide
CID 102690598
N-(3-amino-2,4-dimethylphenyl)-3,5-dimethyl-1H-pyrazole-4-sulfonamide
CID 60972945
N-(2-amino-4,6-dibromophenyl)-3,5-dimethyl-1H-pyrazole-4-sulfonamide
CID 43550690
2-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)pyridine-3-sulfonamide
CID 62145923
2-N-(tert-butylsulfamoyl)pyridine-2,3-diamine
CID 114804966
N-(2-amino-4-bromo-6-methylphenyl)-3,5-dimethyl-1H-pyrazole-4-sulfonamide
CID 43551023
N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-(methylamino)pyridine-3-sulfonamide
CID 62147866
3-amino-N-(3-methyl-2-pyridinyl)pyridine-2-sulfonamide
CID 103303464
N-(4-hydroxyphenyl)-3,5-dimethyl-1H-pyrazole-4-sulfonamide
CID 28785562
N-[4-(aminomethyl)phenyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide
CID 28754462
N-(3,5-dimethylphenyl)-3,5-dimethyl-1H-pyrazole-4-sulfonamide
CID 866897

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-2-pyridinyl)-3,5-dimethyl-1H-pyrazole-4-sulfonamide?
The IUPAC name of N-(3-amino-2-pyridinyl)-3,5-dimethyl-1H-pyrazole-4-sulfonamide (CID 113391851) is N-(3-amino-2-pyridinyl)-3,5-dimethyl-1H-pyrazole-4-sulfonamide.
What is the SMILES notation for N-(3-amino-2-pyridinyl)-3,5-dimethyl-1H-pyrazole-4-sulfonamide?
The canonical SMILES for N-(3-amino-2-pyridinyl)-3,5-dimethyl-1H-pyrazole-4-sulfonamide is Cc1n[nH]c(C)c1S(=O)(=O)Nc1ncccc1N.
What is the InChIKey of N-(3-amino-2-pyridinyl)-3,5-dimethyl-1H-pyrazole-4-sulfonamide?
The InChIKey is DTGIBVRWRYXRJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N5O2S/c1-6-9(7(2)14-13-6)18(16,17)15-10-8(11)4-3-5-12-10/h3-5H,11H2,1-2H3,(H,12,15)(H,13,14).
What are the key properties of N-(3-amino-2-pyridinyl)-3,5-dimethyl-1H-pyrazole-4-sulfonamide?
N-(3-amino-2-pyridinyl)-3,5-dimethyl-1H-pyrazole-4-sulfonamide has a molecular weight of 267.31 g/mol, XLogP of 0.80, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-2-pyridinyl)-3,5-dimethyl-1H-pyrazole-4-sulfonamide is sourced from PubChem (CID 113391851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).