(2R)-N-hydroxy-3-methyl-2-(naphthalen-2-ylsulfonylamino)butanamide

C15H18N2O4S — CID 44608938

IUPAC(2R)-N-hydroxy-3-methyl-2-(naphthalen-2-ylsulfonylamino)butanamide
SMILESCC(C)[C@@H](NS(=O)(=O)c1ccc2ccccc2c1)C(=O)NO
InChIInChI=1S/C15H18N2O4S/c1-10(2)14(15(18)16-19)17-22(20,21)13-8-7-11-5-3-4-6-12(11)9-13/h3-10,14,17,19H,1-2H3,(H,16,18)/t14-/m1/s1
InChIKeyABWKZZSKNBCWLN-CQSZACIVSA-N
MW322.39 g/mol
LogP1.65
Rot. Bonds5

About (2R)-N-hydroxy-3-methyl-2-(naphthalen-2-ylsulfonylamino)butanamide

(2R)-N-hydroxy-3-methyl-2-(naphthalen-2-ylsulfonylamino)butanamide (PubChem CID 44608938) has the molecular formula C15H18N2O4S and a molecular weight of 322.39 g/mol. Its IUPAC name is (2R)-N-hydroxy-3-methyl-2-(naphthalen-2-ylsulfonylamino)butanamide.

Molecular Properties

Compound Name(2R)-N-hydroxy-3-methyl-2-(naphthalen-2-ylsulfonylamino)butanamide
PubChem CID44608938
Molecular FormulaC15H18N2O4S
Molecular Weight322.39 g/mol
Exact Mass322.10
IUPAC Name(2R)-N-hydroxy-3-methyl-2-(naphthalen-2-ylsulfonylamino)butanamide
SMILESCC(C)[C@@H](NS(=O)(=O)c1ccc2ccccc2c1)C(=O)NO
InChIInChI=1S/C15H18N2O4S/c1-10(2)14(15(18)16-19)17-22(20,21)13-8-7-11-5-3-4-6-12(11)9-13/h3-10,14,17,19H,1-2H3,(H,16,18)/t14-/m1/s1
InChIKeyABWKZZSKNBCWLN-CQSZACIVSA-N
XLogP1.65
TPSA95.50 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.39
LogP ≤ 51.65
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (2R)-N-hydroxy-3-methyl-2-(naphthalen-2-ylsulfonylamino)butanamide?
The IUPAC name of (2R)-N-hydroxy-3-methyl-2-(naphthalen-2-ylsulfonylamino)butanamide (CID 44608938) is (2R)-N-hydroxy-3-methyl-2-(naphthalen-2-ylsulfonylamino)butanamide.
What is the SMILES notation for (2R)-N-hydroxy-3-methyl-2-(naphthalen-2-ylsulfonylamino)butanamide?
The canonical SMILES for (2R)-N-hydroxy-3-methyl-2-(naphthalen-2-ylsulfonylamino)butanamide is CC(C)[C@@H](NS(=O)(=O)c1ccc2ccccc2c1)C(=O)NO.
What is the InChIKey of (2R)-N-hydroxy-3-methyl-2-(naphthalen-2-ylsulfonylamino)butanamide?
The InChIKey is ABWKZZSKNBCWLN-CQSZACIVSA-N. The full InChI is InChI=1S/C15H18N2O4S/c1-10(2)14(15(18)16-19)17-22(20,21)13-8-7-11-5-3-4-6-12(11)9-13/h3-10,14,17,19H,1-2H3,(H,16,18)/t14-/m1/s1.
What are the key properties of (2R)-N-hydroxy-3-methyl-2-(naphthalen-2-ylsulfonylamino)butanamide?
(2R)-N-hydroxy-3-methyl-2-(naphthalen-2-ylsulfonylamino)butanamide has a molecular weight of 322.39 g/mol, XLogP of 1.65, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-hydroxy-3-methyl-2-(naphthalen-2-ylsulfonylamino)butanamide is sourced from PubChem (CID 44608938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).