2-[(3-hydroxy-2,2-dimethylcyclobutyl)amino]-N-(2-methoxyethyl)acetamide

C11H22N2O3 — CID 115977450

IUPAC2-[(3-hydroxy-2,2-dimethylcyclobutyl)amino]-N-(2-methoxyethyl)acetamide
SMILESCOCCNC(=O)CNC1CC(O)C1(C)C
InChIInChI=1S/C11H22N2O3/c1-11(2)8(6-9(11)14)13-7-10(15)12-4-5-16-3/h8-9,13-14H,4-7H2,1-3H3,(H,12,15)
InChIKeyVMHVPCVMUCLYIW-UHFFFAOYSA-N
MW230.31 g/mol
LogP-0.50
Rot. Bonds6

About 2-[(3-hydroxy-2,2-dimethylcyclobutyl)amino]-N-(2-methoxyethyl)acetamide

2-[(3-hydroxy-2,2-dimethylcyclobutyl)amino]-N-(2-methoxyethyl)acetamide (PubChem CID 115977450) has the molecular formula C11H22N2O3 and a molecular weight of 230.31 g/mol. Its IUPAC name is 2-[(3-hydroxy-2,2-dimethylcyclobutyl)amino]-N-(2-methoxyethyl)acetamide.

Molecular Properties

Compound Name2-[(3-hydroxy-2,2-dimethylcyclobutyl)amino]-N-(2-methoxyethyl)acetamide
PubChem CID115977450
Molecular FormulaC11H22N2O3
Molecular Weight230.31 g/mol
Exact Mass230.16
IUPAC Name2-[(3-hydroxy-2,2-dimethylcyclobutyl)amino]-N-(2-methoxyethyl)acetamide
SMILESCOCCNC(=O)CNC1CC(O)C1(C)C
InChIInChI=1S/C11H22N2O3/c1-11(2)8(6-9(11)14)13-7-10(15)12-4-5-16-3/h8-9,13-14H,4-7H2,1-3H3,(H,12,15)
InChIKeyVMHVPCVMUCLYIW-UHFFFAOYSA-N
XLogP-0.50
TPSA70.59 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 5-0.50
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

3-(2-methoxyethylamino)-2,2-dimethylcyclobutan-1-ol
CID 112633105
N-(2-methoxyethyl)-2-[(2-methylcyclopropyl)amino]acetamide
CID 62396936
2-[(2,2-dimethyloxan-4-yl)amino]-N-(2-methoxyethyl)acetamide
CID 83032655
2-[(3-methoxycyclobutyl)amino]-N-(2-methoxyethyl)acetamide
CID 104872016
3-[2-(3-methoxypropoxy)ethylamino]-2,2-dimethylcyclobutan-1-ol
CID 103179563
2-[(3-ethoxyspiro[3.5]nonan-1-yl)amino]-N-(2-methoxyethyl)acetamide
CID 115905391
4-[[2-(2-methoxyethylamino)-2-oxoethyl]amino]-2,2,3-trimethylcyclohexane-1-carboxylic acid
CID 102630793
N-(2-methoxyethyl)-3-[(2,2,5,5-tetramethyloxolan-3-yl)amino]propanamide
CID 112700248
N-[2-[(3-hydroxy-2,2-dimethylcyclobutyl)amino]ethyl]-2-methylpropanamide
CID 112633271
N-(2-methoxyethyl)-2-[(4-propan-2-ylcyclohexyl)amino]acetamide
CID 113242883
N-(2-methoxyethyl)-2-[(2-methylcyclohexyl)amino]acetamide
CID 60646854
N-(2-methoxyethyl)-2-[(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)amino]acetamide
CID 65471257

Frequently Asked Questions

What is the IUPAC name of 2-[(3-hydroxy-2,2-dimethylcyclobutyl)amino]-N-(2-methoxyethyl)acetamide?
The IUPAC name of 2-[(3-hydroxy-2,2-dimethylcyclobutyl)amino]-N-(2-methoxyethyl)acetamide (CID 115977450) is 2-[(3-hydroxy-2,2-dimethylcyclobutyl)amino]-N-(2-methoxyethyl)acetamide.
What is the SMILES notation for 2-[(3-hydroxy-2,2-dimethylcyclobutyl)amino]-N-(2-methoxyethyl)acetamide?
The canonical SMILES for 2-[(3-hydroxy-2,2-dimethylcyclobutyl)amino]-N-(2-methoxyethyl)acetamide is COCCNC(=O)CNC1CC(O)C1(C)C.
What is the InChIKey of 2-[(3-hydroxy-2,2-dimethylcyclobutyl)amino]-N-(2-methoxyethyl)acetamide?
The InChIKey is VMHVPCVMUCLYIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O3/c1-11(2)8(6-9(11)14)13-7-10(15)12-4-5-16-3/h8-9,13-14H,4-7H2,1-3H3,(H,12,15).
What are the key properties of 2-[(3-hydroxy-2,2-dimethylcyclobutyl)amino]-N-(2-methoxyethyl)acetamide?
2-[(3-hydroxy-2,2-dimethylcyclobutyl)amino]-N-(2-methoxyethyl)acetamide has a molecular weight of 230.31 g/mol, XLogP of -0.50, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-hydroxy-2,2-dimethylcyclobutyl)amino]-N-(2-methoxyethyl)acetamide is sourced from PubChem (CID 115977450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).