N-ethyl-N-(3-methylbutan-2-yl)-2-(3-methylcyclohexyl)oxyacetamide

C16H31NO2 — CID 86941609

IUPACN-ethyl-N-(3-methylbutan-2-yl)-2-(3-methylcyclohexyl)oxyacetamide
SMILESCCN(C(=O)COC1CCCC(C)C1)C(C)C(C)C
InChIInChI=1S/C16H31NO2/c1-6-17(14(5)12(2)3)16(18)11-19-15-9-7-8-13(4)10-15/h12-15H,6-11H2,1-5H3
InChIKeyRAKAUDGAPDBQNV-UHFFFAOYSA-N
MW269.43 g/mol
LogP3.47
Rot. Bonds6

About N-ethyl-N-(3-methylbutan-2-yl)-2-(3-methylcyclohexyl)oxyacetamide

N-ethyl-N-(3-methylbutan-2-yl)-2-(3-methylcyclohexyl)oxyacetamide (PubChem CID 86941609) has the molecular formula C16H31NO2 and a molecular weight of 269.43 g/mol. Its IUPAC name is N-ethyl-N-(3-methylbutan-2-yl)-2-(3-methylcyclohexyl)oxyacetamide.

Molecular Properties

Compound NameN-ethyl-N-(3-methylbutan-2-yl)-2-(3-methylcyclohexyl)oxyacetamide
PubChem CID86941609
Molecular FormulaC16H31NO2
Molecular Weight269.43 g/mol
Exact Mass269.24
IUPAC NameN-ethyl-N-(3-methylbutan-2-yl)-2-(3-methylcyclohexyl)oxyacetamide
SMILESCCN(C(=O)COC1CCCC(C)C1)C(C)C(C)C
InChIInChI=1S/C16H31NO2/c1-6-17(14(5)12(2)3)16(18)11-19-15-9-7-8-13(4)10-15/h12-15H,6-11H2,1-5H3
InChIKeyRAKAUDGAPDBQNV-UHFFFAOYSA-N
XLogP3.47
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.43
LogP ≤ 53.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-N-(2-hydroxy-2-methylpropyl)-2-(3-methylcyclohexyl)oxyacetamide
CID 111596559
1-cyclohexyl-2-(3-methylcyclohexyl)oxyethanone
CID 104751838
1-(3-ethylcyclohexyl)oxy-3-methylbutan-2-one
CID 79396137
3-[[2-(3-methylcyclohexyl)oxyacetyl]-(oxan-4-yl)amino]propanoic acid
CID 119212443
N-methyl-2-[(1S,3R)-3-methylcyclohexyl]oxy-N-[(1S,2S)-2-methylsulfonylcyclopentyl]acetamide
CID 124856790
1-[3-(1-hydroxyethyl)pyrrolidin-1-yl]-2-(3-methylcyclohexyl)oxyethanone
CID 110022886
N-cyclopentyl-2-[[2-(3-methylcyclohexyl)oxyacetyl]amino]propanamide
CID 75371129
2-[(1S,3R)-3-methylcyclohexyl]oxy-N-[4-[methyl-[2-[(1S,3R)-3-methylcyclohexyl]oxyacetyl]amino]butyl]acetamide
CID 124856388
2-cyclopropyl-3-(3-methylcyclohexyl)oxy-2-(propan-2-ylamino)propanamide
CID 63919936
[(3S)-1,1-dioxothiolan-3-yl] 2-[(1S,3R)-3-methylcyclohexyl]oxyacetate
CID 129423619
(3-methylcyclohexyl) 4-methylpentanoate
CID 123314054
N-(2-acetamidoethyl)-2-[(1S,3R)-3-methylcyclohexyl]oxyacetamide
CID 97023264

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(3-methylbutan-2-yl)-2-(3-methylcyclohexyl)oxyacetamide?
The IUPAC name of N-ethyl-N-(3-methylbutan-2-yl)-2-(3-methylcyclohexyl)oxyacetamide (CID 86941609) is N-ethyl-N-(3-methylbutan-2-yl)-2-(3-methylcyclohexyl)oxyacetamide.
What is the SMILES notation for N-ethyl-N-(3-methylbutan-2-yl)-2-(3-methylcyclohexyl)oxyacetamide?
The canonical SMILES for N-ethyl-N-(3-methylbutan-2-yl)-2-(3-methylcyclohexyl)oxyacetamide is CCN(C(=O)COC1CCCC(C)C1)C(C)C(C)C.
What is the InChIKey of N-ethyl-N-(3-methylbutan-2-yl)-2-(3-methylcyclohexyl)oxyacetamide?
The InChIKey is RAKAUDGAPDBQNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31NO2/c1-6-17(14(5)12(2)3)16(18)11-19-15-9-7-8-13(4)10-15/h12-15H,6-11H2,1-5H3.
What are the key properties of N-ethyl-N-(3-methylbutan-2-yl)-2-(3-methylcyclohexyl)oxyacetamide?
N-ethyl-N-(3-methylbutan-2-yl)-2-(3-methylcyclohexyl)oxyacetamide has a molecular weight of 269.43 g/mol, XLogP of 3.47, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(3-methylbutan-2-yl)-2-(3-methylcyclohexyl)oxyacetamide is sourced from PubChem (CID 86941609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).