N-(3-hydroxycyclohexyl)-2-[(2-methylpropan-2-yl)oxy]acetamide

C12H23NO3 — CID 112604612

IUPACN-(3-hydroxycyclohexyl)-2-[(2-methylpropan-2-yl)oxy]acetamide
SMILESCC(C)(C)OCC(=O)NC1CCCC(O)C1
InChIInChI=1S/C12H23NO3/c1-12(2,3)16-8-11(15)13-9-5-4-6-10(14)7-9/h9-10,14H,4-8H2,1-3H3,(H,13,15)
InChIKeyORMASBUENUQGLU-UHFFFAOYSA-N
MW229.32 g/mol
LogP1.22
Rot. Bonds3

About N-(3-hydroxycyclohexyl)-2-[(2-methylpropan-2-yl)oxy]acetamide

N-(3-hydroxycyclohexyl)-2-[(2-methylpropan-2-yl)oxy]acetamide (PubChem CID 112604612) has the molecular formula C12H23NO3 and a molecular weight of 229.32 g/mol. Its IUPAC name is N-(3-hydroxycyclohexyl)-2-[(2-methylpropan-2-yl)oxy]acetamide.

Molecular Properties

Compound NameN-(3-hydroxycyclohexyl)-2-[(2-methylpropan-2-yl)oxy]acetamide
PubChem CID112604612
Molecular FormulaC12H23NO3
Molecular Weight229.32 g/mol
Exact Mass229.17
IUPAC NameN-(3-hydroxycyclohexyl)-2-[(2-methylpropan-2-yl)oxy]acetamide
SMILESCC(C)(C)OCC(=O)NC1CCCC(O)C1
InChIInChI=1S/C12H23NO3/c1-12(2,3)16-8-11(15)13-9-5-4-6-10(14)7-9/h9-10,14H,4-8H2,1-3H3,(H,13,15)
InChIKeyORMASBUENUQGLU-UHFFFAOYSA-N
XLogP1.22
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.32
LogP ≤ 51.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-cycloheptyl-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 112604811
2-ethoxy-N-[(1S,3R)-3-hydroxycyclohexyl]acetamide
CID 95358222
N-(3-hydroxycyclohexyl)-2-(2-methoxyethoxy)acetamide
CID 103722197
2-[2-[(3-hydroxycyclohexyl)amino]-2-oxoethoxy]acetic acid
CID 61329813
methyl N-(3-hydroxycyclohexyl)carbamate
CID 103626697
3-(tert-butylamino)-N-(3-hydroxycyclohexyl)propanamide
CID 54927744
N-(2-methylcyclohexyl)-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 112604907
N-[4-(2,2-dimethylpropanoyl)cyclohexyl]-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 172516053
N-(3-hydroxycyclohexyl)-2-methylsulfanylacetamide
CID 131160438
N-(1,2-dimethylpiperidin-4-yl)-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 112605581
N-[(2R)-2-aminocyclopropyl]-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 147487636
2-(1-amino-2-methylpropan-2-yl)oxy-N-cyclopentylacetamide
CID 65053009

Frequently Asked Questions

What is the IUPAC name of N-(3-hydroxycyclohexyl)-2-[(2-methylpropan-2-yl)oxy]acetamide?
The IUPAC name of N-(3-hydroxycyclohexyl)-2-[(2-methylpropan-2-yl)oxy]acetamide (CID 112604612) is N-(3-hydroxycyclohexyl)-2-[(2-methylpropan-2-yl)oxy]acetamide.
What is the SMILES notation for N-(3-hydroxycyclohexyl)-2-[(2-methylpropan-2-yl)oxy]acetamide?
The canonical SMILES for N-(3-hydroxycyclohexyl)-2-[(2-methylpropan-2-yl)oxy]acetamide is CC(C)(C)OCC(=O)NC1CCCC(O)C1.
What is the InChIKey of N-(3-hydroxycyclohexyl)-2-[(2-methylpropan-2-yl)oxy]acetamide?
The InChIKey is ORMASBUENUQGLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO3/c1-12(2,3)16-8-11(15)13-9-5-4-6-10(14)7-9/h9-10,14H,4-8H2,1-3H3,(H,13,15).
What are the key properties of N-(3-hydroxycyclohexyl)-2-[(2-methylpropan-2-yl)oxy]acetamide?
N-(3-hydroxycyclohexyl)-2-[(2-methylpropan-2-yl)oxy]acetamide has a molecular weight of 229.32 g/mol, XLogP of 1.22, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-hydroxycyclohexyl)-2-[(2-methylpropan-2-yl)oxy]acetamide is sourced from PubChem (CID 112604612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).