N-(2-adamantyl)-2-methoxyacetamide

C13H21NO2 — CID 24659070

IUPACN-(2-adamantyl)-2-methoxyacetamide
SMILESCOCC(=O)NC1C2CC3CC(C2)CC1C3
InChIInChI=1S/C13H21NO2/c1-16-7-12(15)14-13-10-3-8-2-9(5-10)6-11(13)4-8/h8-11,13H,2-7H2,1H3,(H,14,15)
InChIKeyZBYAVROMRJLGFK-UHFFFAOYSA-N
MW223.32 g/mol
LogP1.57
Rot. Bonds3

About N-(2-adamantyl)-2-methoxyacetamide

N-(2-adamantyl)-2-methoxyacetamide (PubChem CID 24659070) has the molecular formula C13H21NO2 and a molecular weight of 223.32 g/mol. Its IUPAC name is N-(2-adamantyl)-2-methoxyacetamide.

Molecular Properties

Compound NameN-(2-adamantyl)-2-methoxyacetamide
PubChem CID24659070
Molecular FormulaC13H21NO2
Molecular Weight223.32 g/mol
Exact Mass223.16
IUPAC NameN-(2-adamantyl)-2-methoxyacetamide
SMILESCOCC(=O)NC1C2CC3CC(C2)CC1C3
InChIInChI=1S/C13H21NO2/c1-16-7-12(15)14-13-10-3-8-2-9(5-10)6-11(13)4-8/h8-11,13H,2-7H2,1H3,(H,14,15)
InChIKeyZBYAVROMRJLGFK-UHFFFAOYSA-N
XLogP1.57
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

magnesium bis(2-[2-(2-adamantylamino)-2-oxoethoxy]acetate)
CID 158348116
N-(2-adamantyl)-3-oxobutanamide
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N-(2-adamantyl)-2-(4-methoxyphenoxy)acetamide
CID 883714
[2-(2-adamantylamino)-2-oxoethyl] 2-ethoxyacetate
CID 2377056
N-[(1R,2R,4S)-2-bicyclo[2.2.1]heptanyl]-2-methoxyacetamide
CID 96569471
N-(2-adamantyl)-3-methylbutanamide
CID 959856
[2-(2-adamantylamino)-2-oxoethyl] adamantane-1-carboxylate
CID 7514400
N-(2-adamantyl)-2-(azetidin-3-yl)acetamide
CID 64618558
N-(2-adamantyl)-4-hydroxypentanamide
CID 79200321
[2-(2-adamantylamino)-2-oxoethyl] 2,4-dimethyl-1,3-thiazole-5-carboxylate
CID 8828195
N-(2-adamantyl)-2-(4-chloro-3,5-dimethylphenoxy)acetamide
CID 2268550
N-(2-adamantyl)-2-[cyclopropyl(ethyl)amino]acetamide
CID 112818447

Frequently Asked Questions

What is the IUPAC name of N-(2-adamantyl)-2-methoxyacetamide?
The IUPAC name of N-(2-adamantyl)-2-methoxyacetamide (CID 24659070) is N-(2-adamantyl)-2-methoxyacetamide.
What is the SMILES notation for N-(2-adamantyl)-2-methoxyacetamide?
The canonical SMILES for N-(2-adamantyl)-2-methoxyacetamide is COCC(=O)NC1C2CC3CC(C2)CC1C3.
What is the InChIKey of N-(2-adamantyl)-2-methoxyacetamide?
The InChIKey is ZBYAVROMRJLGFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21NO2/c1-16-7-12(15)14-13-10-3-8-2-9(5-10)6-11(13)4-8/h8-11,13H,2-7H2,1H3,(H,14,15).
What are the key properties of N-(2-adamantyl)-2-methoxyacetamide?
N-(2-adamantyl)-2-methoxyacetamide has a molecular weight of 223.32 g/mol, XLogP of 1.57, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-adamantyl)-2-methoxyacetamide is sourced from PubChem (CID 24659070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).