2-cyclohexyloxy-N-(2-ethyl-2-hydroxybutyl)acetamide

C14H27NO3 — CID 111483333

IUPAC2-cyclohexyloxy-N-(2-ethyl-2-hydroxybutyl)acetamide
SMILESCCC(O)(CC)CNC(=O)COC1CCCCC1
InChIInChI=1S/C14H27NO3/c1-3-14(17,4-2)11-15-13(16)10-18-12-8-6-5-7-9-12/h12,17H,3-11H2,1-2H3,(H,15,16)
InChIKeyQGRYPGFFIAHHTJ-UHFFFAOYSA-N
MW257.37 g/mol
LogP2.00
Rot. Bonds7

About 2-cyclohexyloxy-N-(2-ethyl-2-hydroxybutyl)acetamide

2-cyclohexyloxy-N-(2-ethyl-2-hydroxybutyl)acetamide (PubChem CID 111483333) has the molecular formula C14H27NO3 and a molecular weight of 257.37 g/mol. Its IUPAC name is 2-cyclohexyloxy-N-(2-ethyl-2-hydroxybutyl)acetamide.

Molecular Properties

Compound Name2-cyclohexyloxy-N-(2-ethyl-2-hydroxybutyl)acetamide
PubChem CID111483333
Molecular FormulaC14H27NO3
Molecular Weight257.37 g/mol
Exact Mass257.20
IUPAC Name2-cyclohexyloxy-N-(2-ethyl-2-hydroxybutyl)acetamide
SMILESCCC(O)(CC)CNC(=O)COC1CCCCC1
InChIInChI=1S/C14H27NO3/c1-3-14(17,4-2)11-15-13(16)10-18-12-8-6-5-7-9-12/h12,17H,3-11H2,1-2H3,(H,15,16)
InChIKeyQGRYPGFFIAHHTJ-UHFFFAOYSA-N
XLogP2.00
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.37
LogP ≤ 52.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-cyclopentyloxy-N-[(1-hydroxycyclohexyl)methyl]butanamide
CID 95986959
N-[(1-hydroxycyclohexyl)methyl]-2-(2,2,2-trifluoroethoxy)propanamide
CID 111446186
N-[(1-hydroxycyclohexyl)methyl]-2-(2,2,2-trifluoroethoxy)acetamide
CID 111485726
2-ethoxy-N-((1-hydroxycyclopentyl)methyl)acetamide
CID 49754452
N-butyl-2-cyclohexyloxyacetamide
CID 21710569
2-ethoxy-N-(trans-4-hydroxycyclohexyl)acetamide
CID 43389302
N-(2-hydroxy-2-methylpropyl)oxane-2-carboxamide
CID 65110348
N-butyl-2-(3-methylcyclohexyl)oxyacetamide
CID 138564636
2-ethoxy-N-(2-hydroxycyclohexyl)acetamide
CID 14965444
N-(3-cyclohexyloxypropyl)-2-propan-2-yloxyacetamide
CID 48132359
N-(3-cyclohexyloxypropyl)-2-propoxyacetamide
CID 48673051
N-((1-hydroxycyclopentyl)methyl)-2-methoxyacetamide
CID 49754448

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyloxy-N-(2-ethyl-2-hydroxybutyl)acetamide?
The IUPAC name of 2-cyclohexyloxy-N-(2-ethyl-2-hydroxybutyl)acetamide (CID 111483333) is 2-cyclohexyloxy-N-(2-ethyl-2-hydroxybutyl)acetamide.
What is the SMILES notation for 2-cyclohexyloxy-N-(2-ethyl-2-hydroxybutyl)acetamide?
The canonical SMILES for 2-cyclohexyloxy-N-(2-ethyl-2-hydroxybutyl)acetamide is CCC(O)(CC)CNC(=O)COC1CCCCC1.
What is the InChIKey of 2-cyclohexyloxy-N-(2-ethyl-2-hydroxybutyl)acetamide?
The InChIKey is QGRYPGFFIAHHTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO3/c1-3-14(17,4-2)11-15-13(16)10-18-12-8-6-5-7-9-12/h12,17H,3-11H2,1-2H3,(H,15,16).
What are the key properties of 2-cyclohexyloxy-N-(2-ethyl-2-hydroxybutyl)acetamide?
2-cyclohexyloxy-N-(2-ethyl-2-hydroxybutyl)acetamide has a molecular weight of 257.37 g/mol, XLogP of 2.00, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyloxy-N-(2-ethyl-2-hydroxybutyl)acetamide is sourced from PubChem (CID 111483333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).