2-[5-hydroxypentyl(methyl)amino]-N-(2-phenoxyethyl)acetamide

C16H26N2O3 — CID 107204277

IUPAC2-[5-hydroxypentyl(methyl)amino]-N-(2-phenoxyethyl)acetamide
SMILESCN(CCCCCO)CC(=O)NCCOc1ccccc1
InChIInChI=1S/C16H26N2O3/c1-18(11-6-3-7-12-19)14-16(20)17-10-13-21-15-8-4-2-5-9-15/h2,4-5,8-9,19H,3,6-7,10-14H2,1H3,(H,17,20)
InChIKeySLNMEJYPZJTSQY-UHFFFAOYSA-N
MW294.39 g/mol
LogP1.28
Rot. Bonds11

About 2-[5-hydroxypentyl(methyl)amino]-N-(2-phenoxyethyl)acetamide

2-[5-hydroxypentyl(methyl)amino]-N-(2-phenoxyethyl)acetamide (PubChem CID 107204277) has the molecular formula C16H26N2O3 and a molecular weight of 294.39 g/mol. Its IUPAC name is 2-[5-hydroxypentyl(methyl)amino]-N-(2-phenoxyethyl)acetamide.

Molecular Properties

Compound Name2-[5-hydroxypentyl(methyl)amino]-N-(2-phenoxyethyl)acetamide
PubChem CID107204277
Molecular FormulaC16H26N2O3
Molecular Weight294.39 g/mol
Exact Mass294.19
IUPAC Name2-[5-hydroxypentyl(methyl)amino]-N-(2-phenoxyethyl)acetamide
SMILESCN(CCCCCO)CC(=O)NCCOc1ccccc1
InChIInChI=1S/C16H26N2O3/c1-18(11-6-3-7-12-19)14-16(20)17-10-13-21-15-8-4-2-5-9-15/h2,4-5,8-9,19H,3,6-7,10-14H2,1H3,(H,17,20)
InChIKeySLNMEJYPZJTSQY-UHFFFAOYSA-N
XLogP1.28
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.39
LogP ≤ 51.28
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

2-[5-hydroxypentyl(methyl)amino]-N-(3-phenylpropyl)acetamide
CID 107204085
N-[2-(4-chlorophenyl)ethyl]-2-[methyl(3-phenoxypropyl)amino]acetamide
CID 55648751
N-(3,3-dimethylbutyl)-2-[methyl(2-phenoxyethyl)amino]acetamide
CID 87013061
N-[2-(3-chlorophenoxy)ethyl]-2-[2-hydroxyethyl(methyl)amino]acetamide
CID 110899228
2-(diethylamino)-N-(2-phenoxyethyl)acetamide;hydrochloride
CID 3060147
N-(2-phenoxyethyl)-2-(N,3,5-trimethylanilino)acetamide
CID 60525006
N-(butylcarbamoyl)-2-[methyl(2-phenoxyethyl)amino]acetamide
CID 8754959
2-[5-hydroxypentyl(methyl)amino]-N-(1-phenylethyl)acetamide
CID 107204145
N-(4-chlorophenyl)-2-[methyl(3-phenoxypropyl)amino]acetamide
CID 9040068
2-[methyl(3-phenoxypropyl)amino]-N-[2-(trifluoromethyl)phenyl]acetamide
CID 26600684
2-[(2-chloro-6-fluorophenyl)methyl-methylamino]-N-(2-phenoxyethyl)acetamide
CID 18087939
7-phenoxyheptan-1-ol
CID 15856264

Frequently Asked Questions

What is the IUPAC name of 2-[5-hydroxypentyl(methyl)amino]-N-(2-phenoxyethyl)acetamide?
The IUPAC name of 2-[5-hydroxypentyl(methyl)amino]-N-(2-phenoxyethyl)acetamide (CID 107204277) is 2-[5-hydroxypentyl(methyl)amino]-N-(2-phenoxyethyl)acetamide.
What is the SMILES notation for 2-[5-hydroxypentyl(methyl)amino]-N-(2-phenoxyethyl)acetamide?
The canonical SMILES for 2-[5-hydroxypentyl(methyl)amino]-N-(2-phenoxyethyl)acetamide is CN(CCCCCO)CC(=O)NCCOc1ccccc1.
What is the InChIKey of 2-[5-hydroxypentyl(methyl)amino]-N-(2-phenoxyethyl)acetamide?
The InChIKey is SLNMEJYPZJTSQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O3/c1-18(11-6-3-7-12-19)14-16(20)17-10-13-21-15-8-4-2-5-9-15/h2,4-5,8-9,19H,3,6-7,10-14H2,1H3,(H,17,20).
What are the key properties of 2-[5-hydroxypentyl(methyl)amino]-N-(2-phenoxyethyl)acetamide?
2-[5-hydroxypentyl(methyl)amino]-N-(2-phenoxyethyl)acetamide has a molecular weight of 294.39 g/mol, XLogP of 1.28, 11 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-hydroxypentyl(methyl)amino]-N-(2-phenoxyethyl)acetamide is sourced from PubChem (CID 107204277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).