2-[(4-hydroxy-1-methoxybutan-2-yl)amino]-N-(2-methoxyethyl)acetamide

C10H22N2O4 — CID 106159877

IUPAC2-[(4-hydroxy-1-methoxybutan-2-yl)amino]-N-(2-methoxyethyl)acetamide
SMILESCOCCNC(=O)CNC(CCO)COC
InChIInChI=1S/C10H22N2O4/c1-15-6-4-11-10(14)7-12-9(3-5-13)8-16-2/h9,12-13H,3-8H2,1-2H3,(H,11,14)
InChIKeyJDOWUSNAEMUAKJ-UHFFFAOYSA-N
MW234.30 g/mol
LogP-1.26
Rot. Bonds10

About 2-[(4-hydroxy-1-methoxybutan-2-yl)amino]-N-(2-methoxyethyl)acetamide

2-[(4-hydroxy-1-methoxybutan-2-yl)amino]-N-(2-methoxyethyl)acetamide (PubChem CID 106159877) has the molecular formula C10H22N2O4 and a molecular weight of 234.30 g/mol. Its IUPAC name is 2-[(4-hydroxy-1-methoxybutan-2-yl)amino]-N-(2-methoxyethyl)acetamide.

Molecular Properties

Compound Name2-[(4-hydroxy-1-methoxybutan-2-yl)amino]-N-(2-methoxyethyl)acetamide
PubChem CID106159877
Molecular FormulaC10H22N2O4
Molecular Weight234.30 g/mol
Exact Mass234.16
IUPAC Name2-[(4-hydroxy-1-methoxybutan-2-yl)amino]-N-(2-methoxyethyl)acetamide
SMILESCOCCNC(=O)CNC(CCO)COC
InChIInChI=1S/C10H22N2O4/c1-15-6-4-11-10(14)7-12-9(3-5-13)8-16-2/h9,12-13H,3-8H2,1-2H3,(H,11,14)
InChIKeyJDOWUSNAEMUAKJ-UHFFFAOYSA-N
XLogP-1.26
TPSA79.82 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 5-1.26
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-[(5-amino-1-methoxypentan-2-yl)amino]-N-(2-methoxyethyl)acetamide
CID 103390835
N-tert-butyl-2-[(4-hydroxy-1-methoxybutan-2-yl)amino]acetamide
CID 106159964
2-[(4-hydroxy-1-methoxybutan-2-yl)amino]-1-pyrrolidin-1-ylethanone
CID 106159700
N-(4-fluorophenyl)-2-[(4-hydroxy-1-methoxybutan-2-yl)amino]acetamide
CID 106159602
2-[(4-hydroxy-1-methoxybutan-2-yl)amino]-N-methyl-N-propan-2-ylacetamide
CID 106159823
N-(4-chlorophenyl)-2-[(4-hydroxy-1-methoxybutan-2-yl)amino]acetamide
CID 106159836
N-(2,6-dichlorophenyl)-2-[(4-hydroxy-1-methoxybutan-2-yl)amino]acetamide
CID 106159615
methyl 2-[[2-(2-methoxyethylamino)-2-oxoethyl]amino]hexanoate
CID 103868364
butyl 2-[(4-hydroxy-1-methoxybutan-2-yl)amino]acetate
CID 106159517
2-hydroxy-N-(2-methoxyethyl)acetamide
CID 19987818
2-[(4-hydroxy-1-methoxybutan-2-yl)amino]-1-morpholin-4-ylethanone
CID 106159597
5-hydroxy-N-[2-(2-methoxyethylamino)-2-oxoethyl]pentanamide
CID 112549769

Frequently Asked Questions

What is the IUPAC name of 2-[(4-hydroxy-1-methoxybutan-2-yl)amino]-N-(2-methoxyethyl)acetamide?
The IUPAC name of 2-[(4-hydroxy-1-methoxybutan-2-yl)amino]-N-(2-methoxyethyl)acetamide (CID 106159877) is 2-[(4-hydroxy-1-methoxybutan-2-yl)amino]-N-(2-methoxyethyl)acetamide.
What is the SMILES notation for 2-[(4-hydroxy-1-methoxybutan-2-yl)amino]-N-(2-methoxyethyl)acetamide?
The canonical SMILES for 2-[(4-hydroxy-1-methoxybutan-2-yl)amino]-N-(2-methoxyethyl)acetamide is COCCNC(=O)CNC(CCO)COC.
What is the InChIKey of 2-[(4-hydroxy-1-methoxybutan-2-yl)amino]-N-(2-methoxyethyl)acetamide?
The InChIKey is JDOWUSNAEMUAKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O4/c1-15-6-4-11-10(14)7-12-9(3-5-13)8-16-2/h9,12-13H,3-8H2,1-2H3,(H,11,14).
What are the key properties of 2-[(4-hydroxy-1-methoxybutan-2-yl)amino]-N-(2-methoxyethyl)acetamide?
2-[(4-hydroxy-1-methoxybutan-2-yl)amino]-N-(2-methoxyethyl)acetamide has a molecular weight of 234.30 g/mol, XLogP of -1.26, 10 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-hydroxy-1-methoxybutan-2-yl)amino]-N-(2-methoxyethyl)acetamide is sourced from PubChem (CID 106159877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).