N-(3-methyl-2H-indazol-6-yl)piperidine-1-sulfonamide

C13H18N4O2S — CID 136519694

IUPACN-(3-methyl-2H-indazol-6-yl)piperidine-1-sulfonamide
SMILESCc1[nH]nc2cc(NS(=O)(=O)N3CCCCC3)ccc12
InChIInChI=1S/C13H18N4O2S/c1-10-12-6-5-11(9-13(12)15-14-10)16-20(18,19)17-7-3-2-4-8-17/h5-6,9,16H,2-4,7-8H2,1H3,(H,14,15)
InChIKeyKQDHUHRWGPICAF-UHFFFAOYSA-N
MW294.38 g/mol
LogP2.01
Rot. Bonds3

About N-(3-methyl-2H-indazol-6-yl)piperidine-1-sulfonamide

N-(3-methyl-2H-indazol-6-yl)piperidine-1-sulfonamide (PubChem CID 136519694) has the molecular formula C13H18N4O2S and a molecular weight of 294.38 g/mol. Its IUPAC name is N-(3-methyl-2H-indazol-6-yl)piperidine-1-sulfonamide.

Molecular Properties

Compound NameN-(3-methyl-2H-indazol-6-yl)piperidine-1-sulfonamide
PubChem CID136519694
Molecular FormulaC13H18N4O2S
Molecular Weight294.38 g/mol
Exact Mass294.12
IUPAC NameN-(3-methyl-2H-indazol-6-yl)piperidine-1-sulfonamide
SMILESCc1[nH]nc2cc(NS(=O)(=O)N3CCCCC3)ccc12
InChIInChI=1S/C13H18N4O2S/c1-10-12-6-5-11(9-13(12)15-14-10)16-20(18,19)17-7-3-2-4-8-17/h5-6,9,16H,2-4,7-8H2,1H3,(H,14,15)
InChIKeyKQDHUHRWGPICAF-UHFFFAOYSA-N
XLogP2.01
TPSA78.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.38
LogP ≤ 52.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-methyl-6-piperidin-1-ylsulfonyl-2H-indazole
CID 177233056
N-(3,4-dichlorophenyl)-3-methyl-2H-indazole-5-sulfonamide
CID 22567293
N-(1,2,3,4-tetrahydroisoquinolin-7-yl)piperidine-1-sulfonamide
CID 63900725
N-(3-aminophenyl)piperidine-1-sulfonamide
CID 28783328
N-[4-(azepan-1-ylsulfonyl)phenyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide
CID 2683816
N-[3-(3-aminoprop-1-ynyl)-4-methylphenyl]piperidine-1-sulfonamide
CID 63333676
N-(3-bromo-4-fluorophenyl)pyrrolidine-1-sulfonamide
CID 115663199
N-phenylpyrrolidine-1-sulfonamide
CID 45117555
2-chloro-4-(piperidin-1-ylsulfonylamino)benzoic acid
CID 61398444
N-(2-oxo-3,4-dihydro-1,4-benzoxazin-6-yl)piperidine-1-sulfonamide
CID 16764818
N-(4-cyanophenyl)piperidine-1-sulfonamide
CID 28785044
N-(4-methyl-1H-pyrazol-5-yl)pyrrolidine-1-sulfonamide
CID 104620883

Frequently Asked Questions

What is the IUPAC name of N-(3-methyl-2H-indazol-6-yl)piperidine-1-sulfonamide?
The IUPAC name of N-(3-methyl-2H-indazol-6-yl)piperidine-1-sulfonamide (CID 136519694) is N-(3-methyl-2H-indazol-6-yl)piperidine-1-sulfonamide.
What is the SMILES notation for N-(3-methyl-2H-indazol-6-yl)piperidine-1-sulfonamide?
The canonical SMILES for N-(3-methyl-2H-indazol-6-yl)piperidine-1-sulfonamide is Cc1[nH]nc2cc(NS(=O)(=O)N3CCCCC3)ccc12.
What is the InChIKey of N-(3-methyl-2H-indazol-6-yl)piperidine-1-sulfonamide?
The InChIKey is KQDHUHRWGPICAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N4O2S/c1-10-12-6-5-11(9-13(12)15-14-10)16-20(18,19)17-7-3-2-4-8-17/h5-6,9,16H,2-4,7-8H2,1H3,(H,14,15).
What are the key properties of N-(3-methyl-2H-indazol-6-yl)piperidine-1-sulfonamide?
N-(3-methyl-2H-indazol-6-yl)piperidine-1-sulfonamide has a molecular weight of 294.38 g/mol, XLogP of 2.01, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methyl-2H-indazol-6-yl)piperidine-1-sulfonamide is sourced from PubChem (CID 136519694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).