2-[1-hydroxypropan-2-yl(methyl)amino]-N-(2-methoxyethyl)acetamide

C9H20N2O3 — CID 115877350

IUPAC2-[1-hydroxypropan-2-yl(methyl)amino]-N-(2-methoxyethyl)acetamide
SMILESCOCCNC(=O)CN(C)C(C)CO
InChIInChI=1S/C9H20N2O3/c1-8(7-12)11(2)6-9(13)10-4-5-14-3/h8,12H,4-7H2,1-3H3,(H,10,13)
InChIKeyOPHCZADEAIWECG-UHFFFAOYSA-N
MW204.27 g/mol
LogP-0.94
Rot. Bonds7

About 2-[1-hydroxypropan-2-yl(methyl)amino]-N-(2-methoxyethyl)acetamide

2-[1-hydroxypropan-2-yl(methyl)amino]-N-(2-methoxyethyl)acetamide (PubChem CID 115877350) has the molecular formula C9H20N2O3 and a molecular weight of 204.27 g/mol. Its IUPAC name is 2-[1-hydroxypropan-2-yl(methyl)amino]-N-(2-methoxyethyl)acetamide.

Molecular Properties

Compound Name2-[1-hydroxypropan-2-yl(methyl)amino]-N-(2-methoxyethyl)acetamide
PubChem CID115877350
Molecular FormulaC9H20N2O3
Molecular Weight204.27 g/mol
Exact Mass204.15
IUPAC Name2-[1-hydroxypropan-2-yl(methyl)amino]-N-(2-methoxyethyl)acetamide
SMILESCOCCNC(=O)CN(C)C(C)CO
InChIInChI=1S/C9H20N2O3/c1-8(7-12)11(2)6-9(13)10-4-5-14-3/h8,12H,4-7H2,1-3H3,(H,10,13)
InChIKeyOPHCZADEAIWECG-UHFFFAOYSA-N
XLogP-0.94
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.27
LogP ≤ 5-0.94
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-(2-methoxyethyl)-2-[methyl(3-oxopentan-2-yl)amino]acetamide
CID 64866282
N-(2-methoxyethyl)-2-[methyl(3-oxobutan-2-yl)amino]acetamide
CID 60680902
N-(2-methoxyethyl)-2-[[2-(2-methoxyethylamino)-2-oxoethyl]-pentan-3-ylamino]acetamide
CID 55640369
2-[ethylcarbamoyl(methyl)amino]-N-(2-methoxyethyl)acetamide
CID 47128037
2-[butyl(methyl)amino]-N-(2-methoxyethyl)acetamide
CID 108994026
3-(ethylamino)-N-[2-(2-methoxyethylamino)-2-oxoethyl]-N-methylbutanamide
CID 62838866
(2S)-2-amino-N-[2-(2-methoxyethylamino)-2-oxoethyl]-N,3-dimethylbutanamide
CID 61164170
2-hydroxy-N-(2-methoxyethyl)acetamide
CID 19987818
1-[1-hydroxypropan-2-yl(methyl)amino]-3-methoxypropan-2-one
CID 107507543
2-[1-(2-fluoro-4-hydroxyphenyl)ethyl-methylamino]-N-(2-methoxyethyl)acetamide
CID 107721043
N-(2-methoxyethyl)-2-[methyl-[(1S)-1-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]amino]acetamide
CID 94000803
N-butan-2-yl-2-[1-hydroxypropan-2-yl(methyl)amino]acetamide
CID 115877326

Frequently Asked Questions

What is the IUPAC name of 2-[1-hydroxypropan-2-yl(methyl)amino]-N-(2-methoxyethyl)acetamide?
The IUPAC name of 2-[1-hydroxypropan-2-yl(methyl)amino]-N-(2-methoxyethyl)acetamide (CID 115877350) is 2-[1-hydroxypropan-2-yl(methyl)amino]-N-(2-methoxyethyl)acetamide.
What is the SMILES notation for 2-[1-hydroxypropan-2-yl(methyl)amino]-N-(2-methoxyethyl)acetamide?
The canonical SMILES for 2-[1-hydroxypropan-2-yl(methyl)amino]-N-(2-methoxyethyl)acetamide is COCCNC(=O)CN(C)C(C)CO.
What is the InChIKey of 2-[1-hydroxypropan-2-yl(methyl)amino]-N-(2-methoxyethyl)acetamide?
The InChIKey is OPHCZADEAIWECG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O3/c1-8(7-12)11(2)6-9(13)10-4-5-14-3/h8,12H,4-7H2,1-3H3,(H,10,13).
What are the key properties of 2-[1-hydroxypropan-2-yl(methyl)amino]-N-(2-methoxyethyl)acetamide?
2-[1-hydroxypropan-2-yl(methyl)amino]-N-(2-methoxyethyl)acetamide has a molecular weight of 204.27 g/mol, XLogP of -0.94, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-hydroxypropan-2-yl(methyl)amino]-N-(2-methoxyethyl)acetamide is sourced from PubChem (CID 115877350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).