N-cyclohexyl-N-methyl-2-[(2-methylpropan-2-yl)oxy]acetamide

C13H25NO2 — CID 112604739

IUPACN-cyclohexyl-N-methyl-2-[(2-methylpropan-2-yl)oxy]acetamide
SMILESCN(C(=O)COC(C)(C)C)C1CCCCC1
InChIInChI=1S/C13H25NO2/c1-13(2,3)16-10-12(15)14(4)11-8-6-5-7-9-11/h11H,5-10H2,1-4H3
InChIKeyVTFGRQOQWGXUJE-UHFFFAOYSA-N
MW227.35 g/mol
LogP2.59
Rot. Bonds3

About N-cyclohexyl-N-methyl-2-[(2-methylpropan-2-yl)oxy]acetamide

N-cyclohexyl-N-methyl-2-[(2-methylpropan-2-yl)oxy]acetamide (PubChem CID 112604739) has the molecular formula C13H25NO2 and a molecular weight of 227.35 g/mol. Its IUPAC name is N-cyclohexyl-N-methyl-2-[(2-methylpropan-2-yl)oxy]acetamide.

Molecular Properties

Compound NameN-cyclohexyl-N-methyl-2-[(2-methylpropan-2-yl)oxy]acetamide
PubChem CID112604739
Molecular FormulaC13H25NO2
Molecular Weight227.35 g/mol
Exact Mass227.19
IUPAC NameN-cyclohexyl-N-methyl-2-[(2-methylpropan-2-yl)oxy]acetamide
SMILESCN(C(=O)COC(C)(C)C)C1CCCCC1
InChIInChI=1S/C13H25NO2/c1-13(2,3)16-10-12(15)14(4)11-8-6-5-7-9-11/h11H,5-10H2,1-4H3
InChIKeyVTFGRQOQWGXUJE-UHFFFAOYSA-N
XLogP2.59
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.35
LogP ≤ 52.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-2-[(2-methylpropan-2-yl)oxy]-N-(4-oxocyclohexyl)acetamide
CID 112602797
N-[2-(aminomethyl)cyclohexyl]-N-methyl-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 112603464
N-cyclopentyl-N-methyl-2-propan-2-yloxyacetamide
CID 112686921
N-cycloheptyl-2-hydroxy-N-methylacetamide
CID 130678772
N-cyclohexyl-2-[2-[cyclohexyl(methyl)amino]-2-sulfanylideneethoxy]-N-methylacetamide
CID 166451751
2-(2-aminoethoxy)-N-cycloheptyl-N-methylacetamide
CID 79474162
N-cyclohexyl-3-cyclopentyl-N-methylpropanamide
CID 86976959
N,N-dimethyl-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 12636379
2-(tert-butylamino)-N-cyclopentyl-N-methylacetamide
CID 78987089
methyl 4-[cyclohexyl(methyl)amino]-4-oxobutanoate
CID 115174643
2-(1-aminocyclopentyl)-N-cyclohexyl-N-methylacetamide
CID 64684539
N-cyclobutyl-2-hydroxy-N-methylacetamide
CID 115139792

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-N-methyl-2-[(2-methylpropan-2-yl)oxy]acetamide?
The IUPAC name of N-cyclohexyl-N-methyl-2-[(2-methylpropan-2-yl)oxy]acetamide (CID 112604739) is N-cyclohexyl-N-methyl-2-[(2-methylpropan-2-yl)oxy]acetamide.
What is the SMILES notation for N-cyclohexyl-N-methyl-2-[(2-methylpropan-2-yl)oxy]acetamide?
The canonical SMILES for N-cyclohexyl-N-methyl-2-[(2-methylpropan-2-yl)oxy]acetamide is CN(C(=O)COC(C)(C)C)C1CCCCC1.
What is the InChIKey of N-cyclohexyl-N-methyl-2-[(2-methylpropan-2-yl)oxy]acetamide?
The InChIKey is VTFGRQOQWGXUJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25NO2/c1-13(2,3)16-10-12(15)14(4)11-8-6-5-7-9-11/h11H,5-10H2,1-4H3.
What are the key properties of N-cyclohexyl-N-methyl-2-[(2-methylpropan-2-yl)oxy]acetamide?
N-cyclohexyl-N-methyl-2-[(2-methylpropan-2-yl)oxy]acetamide has a molecular weight of 227.35 g/mol, XLogP of 2.59, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-N-methyl-2-[(2-methylpropan-2-yl)oxy]acetamide is sourced from PubChem (CID 112604739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).