N-(1-hydroxy-3-methylbutan-2-yl)pyridine-3-sulfonamide

C10H16N2O3S — CID 79256160

IUPACN-(1-hydroxy-3-methylbutan-2-yl)pyridine-3-sulfonamide
SMILESCC(C)C(CO)NS(=O)(=O)c1cccnc1
InChIInChI=1S/C10H16N2O3S/c1-8(2)10(7-13)12-16(14,15)9-4-3-5-11-6-9/h3-6,8,10,12-13H,7H2,1-2H3
InChIKeyBGALDOCBDSMNNE-UHFFFAOYSA-N
MW244.32 g/mol
LogP0.38
Rot. Bonds5

About N-(1-hydroxy-3-methylbutan-2-yl)pyridine-3-sulfonamide

N-(1-hydroxy-3-methylbutan-2-yl)pyridine-3-sulfonamide (PubChem CID 79256160) has the molecular formula C10H16N2O3S and a molecular weight of 244.32 g/mol. Its IUPAC name is N-(1-hydroxy-3-methylbutan-2-yl)pyridine-3-sulfonamide.

Molecular Properties

Compound NameN-(1-hydroxy-3-methylbutan-2-yl)pyridine-3-sulfonamide
PubChem CID79256160
Molecular FormulaC10H16N2O3S
Molecular Weight244.32 g/mol
Exact Mass244.09
IUPAC NameN-(1-hydroxy-3-methylbutan-2-yl)pyridine-3-sulfonamide
SMILESCC(C)C(CO)NS(=O)(=O)c1cccnc1
InChIInChI=1S/C10H16N2O3S/c1-8(2)10(7-13)12-16(14,15)9-4-3-5-11-6-9/h3-6,8,10,12-13H,7H2,1-2H3
InChIKeyBGALDOCBDSMNNE-UHFFFAOYSA-N
XLogP0.38
TPSA79.29 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.32
LogP ≤ 50.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1-hydroxy-3-methylbutan-2-yl)benzenesulfonamide
CID 73191893
N-(4-hydroxybutan-2-yl)pyridine-3-sulfonamide
CID 115477930
2-(pyridin-3-ylsulfonylamino)propanoic acid
CID 24691769
N-(1-chloropropan-2-yl)pyridine-3-sulfonamide
CID 65030805
3,4-dichloro-N-(1-hydroxy-3-methylbutan-2-yl)benzenesulfonamide
CID 21078673
N-[4-(dimethylamino)butan-2-yl]pyridine-3-sulfonamide
CID 71997346
N-(1-amino-4-methylpentan-2-yl)pyridine-3-sulfonamide
CID 63767546
N-[(2S)-1-hydroxy-3-methylbutan-2-yl]naphthalene-2-sulfonamide
CID 79255723
(2R)-2-(pyridin-3-ylsulfonylamino)pentanoic acid
CID 104935414
[4-[(2S)-2-(pyridin-3-ylsulfonylamino)propanoyl]oxyphenyl] (2S)-2-(pyridin-3-ylsulfonylamino)propanoate
CID 142590055
N-(2-methylpropoxy)pyridine-3-sulfonamide
CID 82715021
N-propylpyridine-3-sulfonamide
CID 43258995

Frequently Asked Questions

What is the IUPAC name of N-(1-hydroxy-3-methylbutan-2-yl)pyridine-3-sulfonamide?
The IUPAC name of N-(1-hydroxy-3-methylbutan-2-yl)pyridine-3-sulfonamide (CID 79256160) is N-(1-hydroxy-3-methylbutan-2-yl)pyridine-3-sulfonamide.
What is the SMILES notation for N-(1-hydroxy-3-methylbutan-2-yl)pyridine-3-sulfonamide?
The canonical SMILES for N-(1-hydroxy-3-methylbutan-2-yl)pyridine-3-sulfonamide is CC(C)C(CO)NS(=O)(=O)c1cccnc1.
What is the InChIKey of N-(1-hydroxy-3-methylbutan-2-yl)pyridine-3-sulfonamide?
The InChIKey is BGALDOCBDSMNNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O3S/c1-8(2)10(7-13)12-16(14,15)9-4-3-5-11-6-9/h3-6,8,10,12-13H,7H2,1-2H3.
What are the key properties of N-(1-hydroxy-3-methylbutan-2-yl)pyridine-3-sulfonamide?
N-(1-hydroxy-3-methylbutan-2-yl)pyridine-3-sulfonamide has a molecular weight of 244.32 g/mol, XLogP of 0.38, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-hydroxy-3-methylbutan-2-yl)pyridine-3-sulfonamide is sourced from PubChem (CID 79256160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).