3-amino-N-(3-methyl-1,2-oxazol-5-yl)-1-propylpyrazole-4-sulfonamide

C10H15N5O3S — CID 54922469

IUPAC3-amino-N-(3-methyl-1,2-oxazol-5-yl)-1-propylpyrazole-4-sulfonamide
SMILESCCCn1cc(S(=O)(=O)Nc2cc(C)no2)c(N)n1
InChIInChI=1S/C10H15N5O3S/c1-3-4-15-6-8(10(11)12-15)19(16,17)14-9-5-7(2)13-18-9/h5-6,14H,3-4H2,1-2H3,(H2,11,12)
InChIKeyFCQHQJXTVJKLKS-UHFFFAOYSA-N
MW285.33 g/mol
LogP0.97
Rot. Bonds5

About 3-amino-N-(3-methyl-1,2-oxazol-5-yl)-1-propylpyrazole-4-sulfonamide

3-amino-N-(3-methyl-1,2-oxazol-5-yl)-1-propylpyrazole-4-sulfonamide (PubChem CID 54922469) has the molecular formula C10H15N5O3S and a molecular weight of 285.33 g/mol. Its IUPAC name is 3-amino-N-(3-methyl-1,2-oxazol-5-yl)-1-propylpyrazole-4-sulfonamide.

Molecular Properties

Compound Name3-amino-N-(3-methyl-1,2-oxazol-5-yl)-1-propylpyrazole-4-sulfonamide
PubChem CID54922469
Molecular FormulaC10H15N5O3S
Molecular Weight285.33 g/mol
Exact Mass285.09
IUPAC Name3-amino-N-(3-methyl-1,2-oxazol-5-yl)-1-propylpyrazole-4-sulfonamide
SMILESCCCn1cc(S(=O)(=O)Nc2cc(C)no2)c(N)n1
InChIInChI=1S/C10H15N5O3S/c1-3-4-15-6-8(10(11)12-15)19(16,17)14-9-5-7(2)13-18-9/h5-6,14H,3-4H2,1-2H3,(H2,11,12)
InChIKeyFCQHQJXTVJKLKS-UHFFFAOYSA-N
XLogP0.97
TPSA116.04 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.33
LogP ≤ 50.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

3-amino-N-(2,5-dimethylpyrazol-3-yl)-1-propylpyrazole-4-sulfonamide
CID 60813517
3-amino-N-(2-methyl-4-pyridinyl)-1-propylpyrazole-4-sulfonamide
CID 79234839
3-amino-N-(2,4-dimethylphenyl)-1-propylpyrazole-4-sulfonamide
CID 60814863
3-amino-N-(2-methylphenyl)-1-propylpyrazole-4-sulfonamide
CID 60808427
3-amino-N-(1-ethylpyrazol-4-yl)-1-propylpyrazole-4-sulfonamide
CID 60808956
3-amino-N-(3,4-difluorophenyl)-1-propylpyrazole-4-sulfonamide
CID 60813521
3-amino-N-(2,3-dimethylbutyl)-1-propylpyrazole-4-sulfonamide
CID 64570397
3-amino-N-(4-chloro-2-fluorophenyl)-1-propylpyrazole-4-sulfonamide
CID 61110443
3-amino-N-(3-chloro-5-fluorophenyl)-1-propylpyrazole-4-sulfonamide
CID 107363544
3-amino-N-(5-methylhexan-2-yl)-1-propylpyrazole-4-sulfonamide
CID 60808316
3-amino-N-but-3-en-2-yl-1-propylpyrazole-4-sulfonamide
CID 113480784
3-amino-N-(4-chloro-2-iodophenyl)-1-propylpyrazole-4-sulfonamide
CID 107624592

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(3-methyl-1,2-oxazol-5-yl)-1-propylpyrazole-4-sulfonamide?
The IUPAC name of 3-amino-N-(3-methyl-1,2-oxazol-5-yl)-1-propylpyrazole-4-sulfonamide (CID 54922469) is 3-amino-N-(3-methyl-1,2-oxazol-5-yl)-1-propylpyrazole-4-sulfonamide.
What is the SMILES notation for 3-amino-N-(3-methyl-1,2-oxazol-5-yl)-1-propylpyrazole-4-sulfonamide?
The canonical SMILES for 3-amino-N-(3-methyl-1,2-oxazol-5-yl)-1-propylpyrazole-4-sulfonamide is CCCn1cc(S(=O)(=O)Nc2cc(C)no2)c(N)n1.
What is the InChIKey of 3-amino-N-(3-methyl-1,2-oxazol-5-yl)-1-propylpyrazole-4-sulfonamide?
The InChIKey is FCQHQJXTVJKLKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N5O3S/c1-3-4-15-6-8(10(11)12-15)19(16,17)14-9-5-7(2)13-18-9/h5-6,14H,3-4H2,1-2H3,(H2,11,12).
What are the key properties of 3-amino-N-(3-methyl-1,2-oxazol-5-yl)-1-propylpyrazole-4-sulfonamide?
3-amino-N-(3-methyl-1,2-oxazol-5-yl)-1-propylpyrazole-4-sulfonamide has a molecular weight of 285.33 g/mol, XLogP of 0.97, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(3-methyl-1,2-oxazol-5-yl)-1-propylpyrazole-4-sulfonamide is sourced from PubChem (CID 54922469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).