N-[(2S)-2-hydroxy-3-methoxy-2-methylpropyl]-N'-(5-methyl-1,2-oxazol-3-yl)oxamide

C11H17N3O5 — CID 95368923

IUPACN-[(2S)-2-hydroxy-3-methoxy-2-methylpropyl]-N'-(5-methyl-1,2-oxazol-3-yl)oxamide
SMILESCOC[C@@](C)(O)CNC(=O)C(=O)Nc1cc(C)on1
InChIInChI=1S/C11H17N3O5/c1-7-4-8(14-19-7)13-10(16)9(15)12-5-11(2,17)6-18-3/h4,17H,5-6H2,1-3H3,(H,12,15)(H,13,14,16)/t11-/m0/s1
InChIKeyHOUWPYQWWMLVRN-NSHDSACASA-N
MW271.27 g/mol
LogP-0.56
Rot. Bonds5

About N-[(2S)-2-hydroxy-3-methoxy-2-methylpropyl]-N'-(5-methyl-1,2-oxazol-3-yl)oxamide

N-[(2S)-2-hydroxy-3-methoxy-2-methylpropyl]-N'-(5-methyl-1,2-oxazol-3-yl)oxamide (PubChem CID 95368923) has the molecular formula C11H17N3O5 and a molecular weight of 271.27 g/mol. Its IUPAC name is N-[(2S)-2-hydroxy-3-methoxy-2-methylpropyl]-N'-(5-methyl-1,2-oxazol-3-yl)oxamide.

Molecular Properties

Compound NameN-[(2S)-2-hydroxy-3-methoxy-2-methylpropyl]-N'-(5-methyl-1,2-oxazol-3-yl)oxamide
PubChem CID95368923
Molecular FormulaC11H17N3O5
Molecular Weight271.27 g/mol
Exact Mass271.12
IUPAC NameN-[(2S)-2-hydroxy-3-methoxy-2-methylpropyl]-N'-(5-methyl-1,2-oxazol-3-yl)oxamide
SMILESCOC[C@@](C)(O)CNC(=O)C(=O)Nc1cc(C)on1
InChIInChI=1S/C11H17N3O5/c1-7-4-8(14-19-7)13-10(16)9(15)12-5-11(2,17)6-18-3/h4,17H,5-6H2,1-3H3,(H,12,15)(H,13,14,16)/t11-/m0/s1
InChIKeyHOUWPYQWWMLVRN-NSHDSACASA-N
XLogP-0.56
TPSA113.69 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.27
LogP ≤ 5-0.56
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}

Analyze N-[(2S)-2-hydroxy-3-methoxy-2-methylpropyl]-N'-(5-methyl-1,2-oxazol-3-yl)oxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-methyl-N'-(5-methyl-1,2-oxazol-3-yl)oxamide
CID 44996069
N-[2-(1,3-benzodioxol-5-yl)-2-hydroxypropyl]-N'-(5-methyl-1,2-oxazol-3-yl)oxamide
CID 71781935
N-(3-chloropropyl)-N'-(5-methyl-1,2-oxazol-3-yl)oxamide
CID 108513695
N'-(5-methyl-1,2-oxazol-3-yl)-N-[(4-methylphenyl)methyl]oxamide
CID 44996026
N'-(3-chlorophenyl)-N-(2-hydroxy-3-methoxy-2-methylpropyl)oxamide
CID 90501064
N'-butan-2-yl-N-(5-methyl-1,2-oxazol-3-yl)oxamide
CID 44996041
N-[2-cyclopropyl-2-(furan-2-yl)-2-hydroxyethyl]-N'-(5-methyl-1,2-oxazol-3-yl)oxamide
CID 71781539
N-(2-ethylhexyl)-N'-(5-methyl-1,2-oxazol-3-yl)oxamide
CID 47205589
N-(2-hydroxy-2-thiophen-2-yl-2-thiophen-3-ylethyl)-N'-(5-methyl-1,2-oxazol-3-yl)oxamide
CID 121170284
N-[(2S)-2-methoxy-2-(2-methylphenyl)ethyl]-N'-(5-methyl-1,2-oxazol-3-yl)oxamide
CID 97417837
N-[2-(4-hydroxyphenyl)ethyl]-N'-(5-methyl-1,2-oxazol-3-yl)oxamide
CID 108503092
3-[(5-methyl-1,2-oxazol-3-yl)amino]-2,3-dioxopropanoic acid
CID 130735467

Frequently Asked Questions

What is the IUPAC name of N-[(2S)-2-hydroxy-3-methoxy-2-methylpropyl]-N'-(5-methyl-1,2-oxazol-3-yl)oxamide?
The IUPAC name of N-[(2S)-2-hydroxy-3-methoxy-2-methylpropyl]-N'-(5-methyl-1,2-oxazol-3-yl)oxamide (CID 95368923) is N-[(2S)-2-hydroxy-3-methoxy-2-methylpropyl]-N'-(5-methyl-1,2-oxazol-3-yl)oxamide.
What is the SMILES notation for N-[(2S)-2-hydroxy-3-methoxy-2-methylpropyl]-N'-(5-methyl-1,2-oxazol-3-yl)oxamide?
The canonical SMILES for N-[(2S)-2-hydroxy-3-methoxy-2-methylpropyl]-N'-(5-methyl-1,2-oxazol-3-yl)oxamide is COC[C@@](C)(O)CNC(=O)C(=O)Nc1cc(C)on1.
What is the InChIKey of N-[(2S)-2-hydroxy-3-methoxy-2-methylpropyl]-N'-(5-methyl-1,2-oxazol-3-yl)oxamide?
The InChIKey is HOUWPYQWWMLVRN-NSHDSACASA-N. The full InChI is InChI=1S/C11H17N3O5/c1-7-4-8(14-19-7)13-10(16)9(15)12-5-11(2,17)6-18-3/h4,17H,5-6H2,1-3H3,(H,12,15)(H,13,14,16)/t11-/m0/s1.
What are the key properties of N-[(2S)-2-hydroxy-3-methoxy-2-methylpropyl]-N'-(5-methyl-1,2-oxazol-3-yl)oxamide?
N-[(2S)-2-hydroxy-3-methoxy-2-methylpropyl]-N'-(5-methyl-1,2-oxazol-3-yl)oxamide has a molecular weight of 271.27 g/mol, XLogP of -0.56, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2S)-2-hydroxy-3-methoxy-2-methylpropyl]-N'-(5-methyl-1,2-oxazol-3-yl)oxamide is sourced from PubChem (CID 95368923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).