N-benzyl-4-hydroxy-N-(2-methoxyethyl)butanamide

C14H21NO3 — CID 79205106

IUPACN-benzyl-4-hydroxy-N-(2-methoxyethyl)butanamide
SMILESCOCCN(Cc1ccccc1)C(=O)CCCO
InChIInChI=1S/C14H21NO3/c1-18-11-9-15(14(17)8-5-10-16)12-13-6-3-2-4-7-13/h2-4,6-7,16H,5,8-12H2,1H3
InChIKeyAWCIFQNRMOSWPJ-UHFFFAOYSA-N
MW251.33 g/mol
LogP1.43
Rot. Bonds8

About N-benzyl-4-hydroxy-N-(2-methoxyethyl)butanamide

N-benzyl-4-hydroxy-N-(2-methoxyethyl)butanamide (PubChem CID 79205106) has the molecular formula C14H21NO3 and a molecular weight of 251.33 g/mol. Its IUPAC name is N-benzyl-4-hydroxy-N-(2-methoxyethyl)butanamide.

Molecular Properties

Compound NameN-benzyl-4-hydroxy-N-(2-methoxyethyl)butanamide
PubChem CID79205106
Molecular FormulaC14H21NO3
Molecular Weight251.33 g/mol
Exact Mass251.15
IUPAC NameN-benzyl-4-hydroxy-N-(2-methoxyethyl)butanamide
SMILESCOCCN(Cc1ccccc1)C(=O)CCCO
InChIInChI=1S/C14H21NO3/c1-18-11-9-15(14(17)8-5-10-16)12-13-6-3-2-4-7-13/h2-4,6-7,16H,5,8-12H2,1H3
InChIKeyAWCIFQNRMOSWPJ-UHFFFAOYSA-N
XLogP1.43
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.33
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-benzyl-N-butyl-4-hydroxybutanamide
CID 139706995
N-benzyl-N-[2-(dimethylamino)ethyl]-4-hydroxybutanamide
CID 79200837
N-benzyl-5-hydroxy-N-(2-hydroxyethyl)pentanamide
CID 79191990
N-benzyl-N-(2-methoxyethyl)-4-thiophen-2-ylbutanamide
CID 78781430
N-benzyl-4-ethoxy-N-(2-hydroxyethyl)butanamide
CID 112729241
2-[benzyl(2-methoxyethyl)amino]-2-oxoacetic acid
CID 127020353
N-benzyl-N-(2-methoxyethyl)-2-(2-methoxyethylamino)acetamide
CID 78914153
6-[benzyl(2-hydroxyethyl)amino]-6-oxohexanoic acid
CID 60948107
N-benzyl-2-(4-fluorophenyl)-N-(2-methoxyethyl)acetamide
CID 78781458
N-benzyl-2-cyclopentyl-N-(2-methoxyethyl)acetamide
CID 86975819
N-benzyl-N-(2-methoxyethyl)-4-oxo-4-thiophen-2-ylbutanamide
CID 78781446
N-benzyl-2,2-difluoro-N-(2-methoxyethyl)acetamide
CID 103515233

Frequently Asked Questions

What is the IUPAC name of N-benzyl-4-hydroxy-N-(2-methoxyethyl)butanamide?
The IUPAC name of N-benzyl-4-hydroxy-N-(2-methoxyethyl)butanamide (CID 79205106) is N-benzyl-4-hydroxy-N-(2-methoxyethyl)butanamide.
What is the SMILES notation for N-benzyl-4-hydroxy-N-(2-methoxyethyl)butanamide?
The canonical SMILES for N-benzyl-4-hydroxy-N-(2-methoxyethyl)butanamide is COCCN(Cc1ccccc1)C(=O)CCCO.
What is the InChIKey of N-benzyl-4-hydroxy-N-(2-methoxyethyl)butanamide?
The InChIKey is AWCIFQNRMOSWPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO3/c1-18-11-9-15(14(17)8-5-10-16)12-13-6-3-2-4-7-13/h2-4,6-7,16H,5,8-12H2,1H3.
What are the key properties of N-benzyl-4-hydroxy-N-(2-methoxyethyl)butanamide?
N-benzyl-4-hydroxy-N-(2-methoxyethyl)butanamide has a molecular weight of 251.33 g/mol, XLogP of 1.43, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-4-hydroxy-N-(2-methoxyethyl)butanamide is sourced from PubChem (CID 79205106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).