N-hydroxy-2,2-dimethyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]butanamide

C11H18N2O2S — CID 156784555

IUPACN-hydroxy-2,2-dimethyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]butanamide
SMILESCCC(C)(C)C(=O)N(O)Cc1cnc(C)s1
InChIInChI=1S/C11H18N2O2S/c1-5-11(3,4)10(14)13(15)7-9-6-12-8(2)16-9/h6,15H,5,7H2,1-4H3
InChIKeyZRCWCURHGHTYKE-UHFFFAOYSA-N
MW242.34 g/mol
LogP2.61
Rot. Bonds4

About N-hydroxy-2,2-dimethyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]butanamide

N-hydroxy-2,2-dimethyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]butanamide (PubChem CID 156784555) has the molecular formula C11H18N2O2S and a molecular weight of 242.34 g/mol. Its IUPAC name is N-hydroxy-2,2-dimethyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]butanamide.

Molecular Properties

Compound NameN-hydroxy-2,2-dimethyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]butanamide
PubChem CID156784555
Molecular FormulaC11H18N2O2S
Molecular Weight242.34 g/mol
Exact Mass242.11
IUPAC NameN-hydroxy-2,2-dimethyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]butanamide
SMILESCCC(C)(C)C(=O)N(O)Cc1cnc(C)s1
InChIInChI=1S/C11H18N2O2S/c1-5-11(3,4)10(14)13(15)7-9-6-12-8(2)16-9/h6,15H,5,7H2,1-4H3
InChIKeyZRCWCURHGHTYKE-UHFFFAOYSA-N
XLogP2.61
TPSA53.43 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.34
LogP ≤ 52.61
H-Bond Donors ≤ 51
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 N-hydroxy-2,2-dimethyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]butanamide?
The IUPAC name of N-hydroxy-2,2-dimethyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]butanamide (CID 156784555) is N-hydroxy-2,2-dimethyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]butanamide.
What is the SMILES notation for N-hydroxy-2,2-dimethyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]butanamide?
The canonical SMILES for N-hydroxy-2,2-dimethyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]butanamide is CCC(C)(C)C(=O)N(O)Cc1cnc(C)s1.
What is the InChIKey of N-hydroxy-2,2-dimethyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]butanamide?
The InChIKey is ZRCWCURHGHTYKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O2S/c1-5-11(3,4)10(14)13(15)7-9-6-12-8(2)16-9/h6,15H,5,7H2,1-4H3.
What are the key properties of N-hydroxy-2,2-dimethyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]butanamide?
N-hydroxy-2,2-dimethyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]butanamide has a molecular weight of 242.34 g/mol, XLogP of 2.61, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-2,2-dimethyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]butanamide is sourced from PubChem (CID 156784555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).