N-(1-amino-4-methylpentan-2-yl)pyridine-3-sulfonamide

C11H19N3O2S — CID 63767546

IUPACN-(1-amino-4-methylpentan-2-yl)pyridine-3-sulfonamide
SMILESCC(C)CC(CN)NS(=O)(=O)c1cccnc1
InChIInChI=1S/C11H19N3O2S/c1-9(2)6-10(7-12)14-17(15,16)11-4-3-5-13-8-11/h3-5,8-10,14H,6-7,12H2,1-2H3
InChIKeySLQZEMGUIBXIDN-UHFFFAOYSA-N
MW257.36 g/mol
LogP0.73
Rot. Bonds6

About N-(1-amino-4-methylpentan-2-yl)pyridine-3-sulfonamide

N-(1-amino-4-methylpentan-2-yl)pyridine-3-sulfonamide (PubChem CID 63767546) has the molecular formula C11H19N3O2S and a molecular weight of 257.36 g/mol. Its IUPAC name is N-(1-amino-4-methylpentan-2-yl)pyridine-3-sulfonamide.

Molecular Properties

Compound NameN-(1-amino-4-methylpentan-2-yl)pyridine-3-sulfonamide
PubChem CID63767546
Molecular FormulaC11H19N3O2S
Molecular Weight257.36 g/mol
Exact Mass257.12
IUPAC NameN-(1-amino-4-methylpentan-2-yl)pyridine-3-sulfonamide
SMILESCC(C)CC(CN)NS(=O)(=O)c1cccnc1
InChIInChI=1S/C11H19N3O2S/c1-9(2)6-10(7-12)14-17(15,16)11-4-3-5-13-8-11/h3-5,8-10,14H,6-7,12H2,1-2H3
InChIKeySLQZEMGUIBXIDN-UHFFFAOYSA-N
XLogP0.73
TPSA85.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.36
LogP ≤ 50.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(2S)-1-aminohexan-2-yl]pyridine-3-sulfonamide
CID 97225499
N-(1-chloropropan-2-yl)pyridine-3-sulfonamide
CID 65030805
N-(1-amino-4-methylpentan-2-yl)-4-bromobenzenesulfonamide
CID 63887954
N-(1-amino-4-methylpentan-2-yl)-3-ethylbenzenesulfonamide;hydrochloride
CID 119983421
N-(1-hydroxy-3-methylbutan-2-yl)pyridine-3-sulfonamide
CID 79256160
N-(4-hydroxybutan-2-yl)pyridine-3-sulfonamide
CID 115477930
N-(1-amino-4-methylpentan-2-yl)-3-(methoxymethyl)benzenesulfonamide;hydrochloride
CID 119983345
N-[(2S)-1-amino-4-methylpentan-2-yl]quinoline-8-sulfonamide
CID 97238593
2-(pyridin-3-ylsulfonylamino)propanoic acid
CID 24691769
N-(2-methylpropoxy)pyridine-3-sulfonamide
CID 82715021
N-(1-amino-4-methylpentan-2-yl)-3,4,5-trifluorobenzenesulfonamide
CID 119983411
N-(1-amino-4-methylpentan-2-yl)-4-(methylsulfonylmethyl)benzenesulfonamide;hydrochloride
CID 119983408

Frequently Asked Questions

What is the IUPAC name of N-(1-amino-4-methylpentan-2-yl)pyridine-3-sulfonamide?
The IUPAC name of N-(1-amino-4-methylpentan-2-yl)pyridine-3-sulfonamide (CID 63767546) is N-(1-amino-4-methylpentan-2-yl)pyridine-3-sulfonamide.
What is the SMILES notation for N-(1-amino-4-methylpentan-2-yl)pyridine-3-sulfonamide?
The canonical SMILES for N-(1-amino-4-methylpentan-2-yl)pyridine-3-sulfonamide is CC(C)CC(CN)NS(=O)(=O)c1cccnc1.
What is the InChIKey of N-(1-amino-4-methylpentan-2-yl)pyridine-3-sulfonamide?
The InChIKey is SLQZEMGUIBXIDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O2S/c1-9(2)6-10(7-12)14-17(15,16)11-4-3-5-13-8-11/h3-5,8-10,14H,6-7,12H2,1-2H3.
What are the key properties of N-(1-amino-4-methylpentan-2-yl)pyridine-3-sulfonamide?
N-(1-amino-4-methylpentan-2-yl)pyridine-3-sulfonamide has a molecular weight of 257.36 g/mol, XLogP of 0.73, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-amino-4-methylpentan-2-yl)pyridine-3-sulfonamide is sourced from PubChem (CID 63767546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).