2-morpholin-3-yl-N-octylacetamide

C14H28N2O2 — CID 113337235

IUPAC2-morpholin-3-yl-N-octylacetamide
SMILESCCCCCCCCNC(=O)CC1COCCN1
InChIInChI=1S/C14H28N2O2/c1-2-3-4-5-6-7-8-16-14(17)11-13-12-18-10-9-15-13/h13,15H,2-12H2,1H3,(H,16,17)
InChIKeyXHDIPBMTBLGCHN-UHFFFAOYSA-N
MW256.39 g/mol
LogP1.84
Rot. Bonds9

About 2-morpholin-3-yl-N-octylacetamide

2-morpholin-3-yl-N-octylacetamide (PubChem CID 113337235) has the molecular formula C14H28N2O2 and a molecular weight of 256.39 g/mol. Its IUPAC name is 2-morpholin-3-yl-N-octylacetamide.

Molecular Properties

Compound Name2-morpholin-3-yl-N-octylacetamide
PubChem CID113337235
Molecular FormulaC14H28N2O2
Molecular Weight256.39 g/mol
Exact Mass256.22
IUPAC Name2-morpholin-3-yl-N-octylacetamide
SMILESCCCCCCCCNC(=O)CC1COCCN1
InChIInChI=1S/C14H28N2O2/c1-2-3-4-5-6-7-8-16-14(17)11-13-12-18-10-9-15-13/h13,15H,2-12H2,1H3,(H,16,17)
InChIKeyXHDIPBMTBLGCHN-UHFFFAOYSA-N
XLogP1.84
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 51.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-hex-5-ynyl-2-morpholin-3-ylacetamide
CID 106213141
N-octyl-2-pyrrolidin-2-ylacetamide
CID 115567860
2-morpholin-3-yl-N-octan-4-ylacetamide
CID 114138382
N-(2-methylprop-2-enyl)-2-morpholin-3-ylacetamide
CID 114617037
2-(1,1-dioxo-1,4-thiazinan-3-yl)-N-octylacetamide
CID 115568056
N-[[1-(dimethylamino)cyclobutyl]methyl]-2-morpholin-3-ylacetamide
CID 105417370
N-(3,3-diphenylpropyl)-2-[(3S)-morpholin-3-yl]acetamide
CID 95723724
N-(2-but-3-enoxyethyl)-2-morpholin-3-ylacetamide
CID 106398158
N-[(4-hydroxyoxan-4-yl)methyl]-2-morpholin-3-ylacetamide
CID 81130635
2-cyclopropyl-N-(morpholin-3-ylmethyl)acetamide
CID 103548657
2-[1-[[(2-morpholin-3-ylacetyl)amino]methyl]cyclobutyl]acetic acid
CID 81161091
1-ethyl-3-(morpholin-3-ylmethyl)urea
CID 103548754

Frequently Asked Questions

What is the IUPAC name of 2-morpholin-3-yl-N-octylacetamide?
The IUPAC name of 2-morpholin-3-yl-N-octylacetamide (CID 113337235) is 2-morpholin-3-yl-N-octylacetamide.
What is the SMILES notation for 2-morpholin-3-yl-N-octylacetamide?
The canonical SMILES for 2-morpholin-3-yl-N-octylacetamide is CCCCCCCCNC(=O)CC1COCCN1.
What is the InChIKey of 2-morpholin-3-yl-N-octylacetamide?
The InChIKey is XHDIPBMTBLGCHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O2/c1-2-3-4-5-6-7-8-16-14(17)11-13-12-18-10-9-15-13/h13,15H,2-12H2,1H3,(H,16,17).
What are the key properties of 2-morpholin-3-yl-N-octylacetamide?
2-morpholin-3-yl-N-octylacetamide has a molecular weight of 256.39 g/mol, XLogP of 1.84, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-morpholin-3-yl-N-octylacetamide is sourced from PubChem (CID 113337235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).