N-[3-(2-ethoxyphenyl)propyl]-2-morpholin-2-ylacetamide

C17H26N2O3 — CID 77086074

IUPACN-[3-(2-ethoxyphenyl)propyl]-2-morpholin-2-ylacetamide
SMILESCCOc1ccccc1CCCNC(=O)CC1CNCCO1
InChIInChI=1S/C17H26N2O3/c1-2-21-16-8-4-3-6-14(16)7-5-9-19-17(20)12-15-13-18-10-11-22-15/h3-4,6,8,15,18H,2,5,7,9-13H2,1H3,(H,19,20)
InChIKeyQKNBKIMDVAAVOC-UHFFFAOYSA-N
MW306.41 g/mol
LogP1.51
Rot. Bonds8

About N-[3-(2-ethoxyphenyl)propyl]-2-morpholin-2-ylacetamide

N-[3-(2-ethoxyphenyl)propyl]-2-morpholin-2-ylacetamide (PubChem CID 77086074) has the molecular formula C17H26N2O3 and a molecular weight of 306.41 g/mol. Its IUPAC name is N-[3-(2-ethoxyphenyl)propyl]-2-morpholin-2-ylacetamide.

Molecular Properties

Compound NameN-[3-(2-ethoxyphenyl)propyl]-2-morpholin-2-ylacetamide
PubChem CID77086074
Molecular FormulaC17H26N2O3
Molecular Weight306.41 g/mol
Exact Mass306.19
IUPAC NameN-[3-(2-ethoxyphenyl)propyl]-2-morpholin-2-ylacetamide
SMILESCCOc1ccccc1CCCNC(=O)CC1CNCCO1
InChIInChI=1S/C17H26N2O3/c1-2-21-16-8-4-3-6-14(16)7-5-9-19-17(20)12-15-13-18-10-11-22-15/h3-4,6,8,15,18H,2,5,7,9-13H2,1H3,(H,19,20)
InChIKeyQKNBKIMDVAAVOC-UHFFFAOYSA-N
XLogP1.51
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.41
LogP ≤ 51.51
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

N-[3-(2-ethoxyphenyl)propyl]-2-[(2S)-morpholin-2-yl]acetamide
CID 99932617
2-morpholin-2-yl-N-(2-phenylethyl)acetamide
CID 66434342
N-[(2-hydroxyphenyl)methyl]-2-morpholin-2-ylacetamide
CID 114332328
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-morpholin-2-ylacetamide
CID 119675375
N-(4-methylpentyl)-2-morpholin-2-ylacetamide
CID 66428292
N-[2-(N-methylanilino)ethyl]-2-morpholin-2-ylacetamide;dihydrochloride
CID 119837655
bis(2-[(2-ethoxyphenoxy)methyl]morpholine);hydrochloride
CID 157316678
N-(2,5-diethoxyphenyl)-2-morpholin-2-ylacetamide;hydrochloride
CID 119686964
2-[(2-ethoxyphenoxy)methyl]morpholine;methane
CID 158820908
N-[2-(2-ethoxyphenyl)ethyl]pyrrolidine-3-carboxamide
CID 119772912
N-[3-(2-ethoxyphenyl)propyl]-2-(4-methoxyphenyl)acetamide
CID 92673607
2-[[2-(4-phenylbutyl)phenoxy]methyl]morpholine
CID 19424036

Frequently Asked Questions

What is the IUPAC name of N-[3-(2-ethoxyphenyl)propyl]-2-morpholin-2-ylacetamide?
The IUPAC name of N-[3-(2-ethoxyphenyl)propyl]-2-morpholin-2-ylacetamide (CID 77086074) is N-[3-(2-ethoxyphenyl)propyl]-2-morpholin-2-ylacetamide.
What is the SMILES notation for N-[3-(2-ethoxyphenyl)propyl]-2-morpholin-2-ylacetamide?
The canonical SMILES for N-[3-(2-ethoxyphenyl)propyl]-2-morpholin-2-ylacetamide is CCOc1ccccc1CCCNC(=O)CC1CNCCO1.
What is the InChIKey of N-[3-(2-ethoxyphenyl)propyl]-2-morpholin-2-ylacetamide?
The InChIKey is QKNBKIMDVAAVOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O3/c1-2-21-16-8-4-3-6-14(16)7-5-9-19-17(20)12-15-13-18-10-11-22-15/h3-4,6,8,15,18H,2,5,7,9-13H2,1H3,(H,19,20).
What are the key properties of N-[3-(2-ethoxyphenyl)propyl]-2-morpholin-2-ylacetamide?
N-[3-(2-ethoxyphenyl)propyl]-2-morpholin-2-ylacetamide has a molecular weight of 306.41 g/mol, XLogP of 1.51, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(2-ethoxyphenyl)propyl]-2-morpholin-2-ylacetamide is sourced from PubChem (CID 77086074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).