2-[(4-hydroxy-2-methylbutyl)amino]-N-(2-methoxyethyl)propanamide

C11H24N2O3 — CID 66106825

IUPAC2-[(4-hydroxy-2-methylbutyl)amino]-N-(2-methoxyethyl)propanamide
SMILESCOCCNC(=O)C(C)NCC(C)CCO
InChIInChI=1S/C11H24N2O3/c1-9(4-6-14)8-13-10(2)11(15)12-5-7-16-3/h9-10,13-14H,4-8H2,1-3H3,(H,12,15)
InChIKeyUZAOTCJIWNKLBD-UHFFFAOYSA-N
MW232.32 g/mol
LogP-0.25
Rot. Bonds9

About 2-[(4-hydroxy-2-methylbutyl)amino]-N-(2-methoxyethyl)propanamide

2-[(4-hydroxy-2-methylbutyl)amino]-N-(2-methoxyethyl)propanamide (PubChem CID 66106825) has the molecular formula C11H24N2O3 and a molecular weight of 232.32 g/mol. Its IUPAC name is 2-[(4-hydroxy-2-methylbutyl)amino]-N-(2-methoxyethyl)propanamide.

Molecular Properties

Compound Name2-[(4-hydroxy-2-methylbutyl)amino]-N-(2-methoxyethyl)propanamide
PubChem CID66106825
Molecular FormulaC11H24N2O3
Molecular Weight232.32 g/mol
Exact Mass232.18
IUPAC Name2-[(4-hydroxy-2-methylbutyl)amino]-N-(2-methoxyethyl)propanamide
SMILESCOCCNC(=O)C(C)NCC(C)CCO
InChIInChI=1S/C11H24N2O3/c1-9(4-6-14)8-13-10(2)11(15)12-5-7-16-3/h9-10,13-14H,4-8H2,1-3H3,(H,12,15)
InChIKeyUZAOTCJIWNKLBD-UHFFFAOYSA-N
XLogP-0.25
TPSA70.59 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.32
LogP ≤ 5-0.25
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

N-(2-methoxyethyl)-2-(2-methylbutylamino)propanamide
CID 62694565
2-[(4-hydroxy-2-methylbutyl)amino]-N-prop-2-ynylpropanamide
CID 66107036
2-(3-hydroxybutylamino)-N-(2-methoxyethyl)propanamide
CID 64913516
2-[[1-(carbamoylamino)-1-oxopropan-2-yl]amino]-N-(2-methoxyethyl)propanamide
CID 113407032
N-(2-methoxyethyl)-2-(propan-2-ylamino)propanamide
CID 43086718
2-amino-N-(4-hydroxy-2-methylbutyl)-3-methoxypropanamide
CID 81102467
2-[[(E)-but-2-enyl]amino]-N-(2-methoxyethyl)propanamide
CID 107899218
N-(2-methoxyethyl)-2-(nonylamino)propanamide
CID 115574851
N-[1-(2-methoxyethylamino)-1-oxopropan-2-yl]-2-methyl-3-(methylamino)propanamide
CID 113407197
methyl N-(4-hydroxy-2-methylbutyl)carbamate
CID 66107566
2-(2,2-dimethylhydrazinyl)-N-(2-methoxyethyl)propanamide
CID 83013633
2-[[2-(butan-2-ylamino)-2-oxoethyl]amino]-N-(2-methoxyethyl)propanamide
CID 113407011

Frequently Asked Questions

What is the IUPAC name of 2-[(4-hydroxy-2-methylbutyl)amino]-N-(2-methoxyethyl)propanamide?
The IUPAC name of 2-[(4-hydroxy-2-methylbutyl)amino]-N-(2-methoxyethyl)propanamide (CID 66106825) is 2-[(4-hydroxy-2-methylbutyl)amino]-N-(2-methoxyethyl)propanamide.
What is the SMILES notation for 2-[(4-hydroxy-2-methylbutyl)amino]-N-(2-methoxyethyl)propanamide?
The canonical SMILES for 2-[(4-hydroxy-2-methylbutyl)amino]-N-(2-methoxyethyl)propanamide is COCCNC(=O)C(C)NCC(C)CCO.
What is the InChIKey of 2-[(4-hydroxy-2-methylbutyl)amino]-N-(2-methoxyethyl)propanamide?
The InChIKey is UZAOTCJIWNKLBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O3/c1-9(4-6-14)8-13-10(2)11(15)12-5-7-16-3/h9-10,13-14H,4-8H2,1-3H3,(H,12,15).
What are the key properties of 2-[(4-hydroxy-2-methylbutyl)amino]-N-(2-methoxyethyl)propanamide?
2-[(4-hydroxy-2-methylbutyl)amino]-N-(2-methoxyethyl)propanamide has a molecular weight of 232.32 g/mol, XLogP of -0.25, 9 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-hydroxy-2-methylbutyl)amino]-N-(2-methoxyethyl)propanamide is sourced from PubChem (CID 66106825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).