2-cyclohexyl-N-[2-(2-methylprop-2-enoxy)ethyl]acetamide

C14H25NO2 — CID 113258414

IUPAC2-cyclohexyl-N-[2-(2-methylprop-2-enoxy)ethyl]acetamide
SMILESC=C(C)COCCNC(=O)CC1CCCCC1
InChIInChI=1S/C14H25NO2/c1-12(2)11-17-9-8-15-14(16)10-13-6-4-3-5-7-13/h13H,1,3-11H2,2H3,(H,15,16)
InChIKeyFOHZDTKHCOSVEJ-UHFFFAOYSA-N
MW239.36 g/mol
LogP2.67
Rot. Bonds7

About 2-cyclohexyl-N-[2-(2-methylprop-2-enoxy)ethyl]acetamide

2-cyclohexyl-N-[2-(2-methylprop-2-enoxy)ethyl]acetamide (PubChem CID 113258414) has the molecular formula C14H25NO2 and a molecular weight of 239.36 g/mol. Its IUPAC name is 2-cyclohexyl-N-[2-(2-methylprop-2-enoxy)ethyl]acetamide.

Molecular Properties

Compound Name2-cyclohexyl-N-[2-(2-methylprop-2-enoxy)ethyl]acetamide
PubChem CID113258414
Molecular FormulaC14H25NO2
Molecular Weight239.36 g/mol
Exact Mass239.19
IUPAC Name2-cyclohexyl-N-[2-(2-methylprop-2-enoxy)ethyl]acetamide
SMILESC=C(C)COCCNC(=O)CC1CCCCC1
InChIInChI=1S/C14H25NO2/c1-12(2)11-17-9-8-15-14(16)10-13-6-4-3-5-7-13/h13H,1,3-11H2,2H3,(H,15,16)
InChIKeyFOHZDTKHCOSVEJ-UHFFFAOYSA-N
XLogP2.67
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-[2-[(2-cyclohexylacetyl)amino]ethoxy]acetic acid
CID 79457520
N-[2-(2-methylprop-2-enoxy)ethyl]-3-piperidin-3-ylpropanamide
CID 114467819
N-[2-(2-methylprop-2-enoxy)ethyl]propanamide
CID 115700214
N-[2-(2-chloroethoxy)ethyl]-2-cyclobutylacetamide
CID 103166701
N-(3-butoxypropyl)-2-cyclopentylacetamide
CID 78785153
N-[2-(2-methylprop-2-enoxy)ethyl]-2-sulfanylacetamide
CID 114469847
2-(4-aminocyclohexyl)-N-[2-(2-amino-2-oxoethoxy)ethyl]acetamide
CID 114162833
2-cyclobutyl-N-[2-[2-[(3E)-5-fluoro-2-methylhexa-1,3,5-trien-3-yl]oxyethoxy]ethyl]acetamide;ethane
CID 176700323
2-[1-(methylamino)cyclohexyl]-N-[2-(2-methylprop-2-enoxy)ethyl]acetamide
CID 114467920
2-cycloheptyl-N-[2-(propan-2-ylamino)ethyl]acetamide
CID 114458404
3-(methylamino)-N-[2-(2-methylprop-2-enoxy)ethyl]propanamide
CID 114467912
3-amino-N-[2-(2-methylprop-2-enoxy)ethyl]propanamide
CID 114467833

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-N-[2-(2-methylprop-2-enoxy)ethyl]acetamide?
The IUPAC name of 2-cyclohexyl-N-[2-(2-methylprop-2-enoxy)ethyl]acetamide (CID 113258414) is 2-cyclohexyl-N-[2-(2-methylprop-2-enoxy)ethyl]acetamide.
What is the SMILES notation for 2-cyclohexyl-N-[2-(2-methylprop-2-enoxy)ethyl]acetamide?
The canonical SMILES for 2-cyclohexyl-N-[2-(2-methylprop-2-enoxy)ethyl]acetamide is C=C(C)COCCNC(=O)CC1CCCCC1.
What is the InChIKey of 2-cyclohexyl-N-[2-(2-methylprop-2-enoxy)ethyl]acetamide?
The InChIKey is FOHZDTKHCOSVEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25NO2/c1-12(2)11-17-9-8-15-14(16)10-13-6-4-3-5-7-13/h13H,1,3-11H2,2H3,(H,15,16).
What are the key properties of 2-cyclohexyl-N-[2-(2-methylprop-2-enoxy)ethyl]acetamide?
2-cyclohexyl-N-[2-(2-methylprop-2-enoxy)ethyl]acetamide has a molecular weight of 239.36 g/mol, XLogP of 2.67, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-N-[2-(2-methylprop-2-enoxy)ethyl]acetamide is sourced from PubChem (CID 113258414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).