N-[(2R)-1-hydroxybutan-2-yl]-2-(2-methoxyethoxy)acetamide

C9H19NO4 — CID 103920046

IUPACN-[(2R)-1-hydroxybutan-2-yl]-2-(2-methoxyethoxy)acetamide
SMILESCC[C@H](CO)NC(=O)COCCOC
InChIInChI=1S/C9H19NO4/c1-3-8(6-11)10-9(12)7-14-5-4-13-2/h8,11H,3-7H2,1-2H3,(H,10,12)/t8-/m1/s1
InChIKeyOZOLLFZOPDEXMA-MRVPVSSYSA-N
MW205.25 g/mol
LogP-0.46
Rot. Bonds8

About N-[(2R)-1-hydroxybutan-2-yl]-2-(2-methoxyethoxy)acetamide

N-[(2R)-1-hydroxybutan-2-yl]-2-(2-methoxyethoxy)acetamide (PubChem CID 103920046) has the molecular formula C9H19NO4 and a molecular weight of 205.25 g/mol. Its IUPAC name is N-[(2R)-1-hydroxybutan-2-yl]-2-(2-methoxyethoxy)acetamide.

Molecular Properties

Compound NameN-[(2R)-1-hydroxybutan-2-yl]-2-(2-methoxyethoxy)acetamide
PubChem CID103920046
Molecular FormulaC9H19NO4
Molecular Weight205.25 g/mol
Exact Mass205.13
IUPAC NameN-[(2R)-1-hydroxybutan-2-yl]-2-(2-methoxyethoxy)acetamide
SMILESCC[C@H](CO)NC(=O)COCCOC
InChIInChI=1S/C9H19NO4/c1-3-8(6-11)10-9(12)7-14-5-4-13-2/h8,11H,3-7H2,1-2H3,(H,10,12)/t8-/m1/s1
InChIKeyOZOLLFZOPDEXMA-MRVPVSSYSA-N
XLogP-0.46
TPSA67.79 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.25
LogP ≤ 5-0.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-[(2R)-1-hydroxybutan-2-yl]-3-methoxypropanamide
CID 103920011
N-[(2S)-1-hydroxybutan-2-yl]-4-methoxybutanamide
CID 104981240
N-butan-2-yl-2-(2-methoxyethoxy)acetamide
CID 60650985
2-(2-aminoethoxy)-N-(1-methoxybutan-2-yl)acetamide
CID 79478592
methyl 3-hydroxy-2-[[2-(2-methoxyethoxy)acetyl]amino]propanoate
CID 43422807
N-(1-hydroxy-3-methylbutan-2-yl)-2-(2-methoxyethoxy)acetamide
CID 79255861
N-(1,3-dihydroxypropan-2-yl)-2-ethoxyacetamide
CID 65314889
N-(1-hydroxybutan-2-yl)-2-(2-methoxyethylsulfanyl)acetamide
CID 43427721
N-[(2R)-1-hydroxybutan-2-yl]-2-propan-2-yloxyacetamide
CID 103920021
2-(2-methoxyethoxy)-N-pentan-2-ylacetamide
CID 103601639
N-(1-hydroxybutan-2-yl)-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 112603120
(2S)-2-[[2-(2-methoxyethoxy)acetyl]amino]-3-methylpentanoic acid
CID 61172189

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-1-hydroxybutan-2-yl]-2-(2-methoxyethoxy)acetamide?
The IUPAC name of N-[(2R)-1-hydroxybutan-2-yl]-2-(2-methoxyethoxy)acetamide (CID 103920046) is N-[(2R)-1-hydroxybutan-2-yl]-2-(2-methoxyethoxy)acetamide.
What is the SMILES notation for N-[(2R)-1-hydroxybutan-2-yl]-2-(2-methoxyethoxy)acetamide?
The canonical SMILES for N-[(2R)-1-hydroxybutan-2-yl]-2-(2-methoxyethoxy)acetamide is CC[C@H](CO)NC(=O)COCCOC.
What is the InChIKey of N-[(2R)-1-hydroxybutan-2-yl]-2-(2-methoxyethoxy)acetamide?
The InChIKey is OZOLLFZOPDEXMA-MRVPVSSYSA-N. The full InChI is InChI=1S/C9H19NO4/c1-3-8(6-11)10-9(12)7-14-5-4-13-2/h8,11H,3-7H2,1-2H3,(H,10,12)/t8-/m1/s1.
What are the key properties of N-[(2R)-1-hydroxybutan-2-yl]-2-(2-methoxyethoxy)acetamide?
N-[(2R)-1-hydroxybutan-2-yl]-2-(2-methoxyethoxy)acetamide has a molecular weight of 205.25 g/mol, XLogP of -0.46, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-1-hydroxybutan-2-yl]-2-(2-methoxyethoxy)acetamide is sourced from PubChem (CID 103920046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).