N-(2-methylpropoxy)pyridine-3-sulfonamide

C9H14N2O3S — CID 82715021

IUPACN-(2-methylpropoxy)pyridine-3-sulfonamide
SMILESCC(C)CONS(=O)(=O)c1cccnc1
InChIInChI=1S/C9H14N2O3S/c1-8(2)7-14-11-15(12,13)9-4-3-5-10-6-9/h3-6,8,11H,7H2,1-2H3
InChIKeyJXHCDETYJAZFLS-UHFFFAOYSA-N
MW230.29 g/mol
LogP0.95
Rot. Bonds5

About N-(2-methylpropoxy)pyridine-3-sulfonamide

N-(2-methylpropoxy)pyridine-3-sulfonamide (PubChem CID 82715021) has the molecular formula C9H14N2O3S and a molecular weight of 230.29 g/mol. Its IUPAC name is N-(2-methylpropoxy)pyridine-3-sulfonamide.

Molecular Properties

Compound NameN-(2-methylpropoxy)pyridine-3-sulfonamide
PubChem CID82715021
Molecular FormulaC9H14N2O3S
Molecular Weight230.29 g/mol
Exact Mass230.07
IUPAC NameN-(2-methylpropoxy)pyridine-3-sulfonamide
SMILESCC(C)CONS(=O)(=O)c1cccnc1
InChIInChI=1S/C9H14N2O3S/c1-8(2)7-14-11-15(12,13)9-4-3-5-10-6-9/h3-6,8,11H,7H2,1-2H3
InChIKeyJXHCDETYJAZFLS-UHFFFAOYSA-N
XLogP0.95
TPSA68.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.29
LogP ≤ 50.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-[2-(diethylamino)propyl]pyridine-3-sulfonamide
CID 60548624
N-(1-chloropropan-2-yl)pyridine-3-sulfonamide
CID 65030805
3-(2-methylpropylsulfonyl)pyridine
CID 166834776
N-(1-amino-4-methylpentan-2-yl)pyridine-3-sulfonamide
CID 63767546
N-propylpyridine-3-sulfonamide
CID 43258995
4-butan-2-yl-N-(2-methylpropoxy)benzenesulfonamide
CID 82715696
N-(1-hydroxy-3-methylbutan-2-yl)pyridine-3-sulfonamide
CID 79256160
N-(4-hydroxybutan-2-yl)pyridine-3-sulfonamide
CID 115477930
N-[4-[6-(2-methylpropoxy)pyridazin-3-yl]phenyl]pyridine-3-sulfonamide
CID 7519314
3,4-difluoro-N-(2-methylpropoxy)benzenesulfonamide
CID 82715795
2-(pyridin-3-ylsulfonylamino)propanoic acid
CID 24691769
N-(3-amino-2,2-dimethylpropyl)pyridine-3-sulfonamide
CID 115365958

Frequently Asked Questions

What is the IUPAC name of N-(2-methylpropoxy)pyridine-3-sulfonamide?
The IUPAC name of N-(2-methylpropoxy)pyridine-3-sulfonamide (CID 82715021) is N-(2-methylpropoxy)pyridine-3-sulfonamide.
What is the SMILES notation for N-(2-methylpropoxy)pyridine-3-sulfonamide?
The canonical SMILES for N-(2-methylpropoxy)pyridine-3-sulfonamide is CC(C)CONS(=O)(=O)c1cccnc1.
What is the InChIKey of N-(2-methylpropoxy)pyridine-3-sulfonamide?
The InChIKey is JXHCDETYJAZFLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O3S/c1-8(2)7-14-11-15(12,13)9-4-3-5-10-6-9/h3-6,8,11H,7H2,1-2H3.
What are the key properties of N-(2-methylpropoxy)pyridine-3-sulfonamide?
N-(2-methylpropoxy)pyridine-3-sulfonamide has a molecular weight of 230.29 g/mol, XLogP of 0.95, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpropoxy)pyridine-3-sulfonamide is sourced from PubChem (CID 82715021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).