N-(1-adamantyl)-2-(dimethylaminooxy)acetamide

C14H24N2O2 — CID 161464424

IUPACN-(1-adamantyl)-2-(dimethylaminooxy)acetamide
SMILESCN(C)OCC(=O)NC12CC3CC(CC(C3)C1)C2
InChIInChI=1S/C14H24N2O2/c1-16(2)18-9-13(17)15-14-6-10-3-11(7-14)5-12(4-10)8-14/h10-12H,3-9H2,1-2H3,(H,15,17)
InChIKeyOGFPPKTYXIDKNZ-UHFFFAOYSA-N
MW252.36 g/mol
LogP1.56
Rot. Bonds4

About N-(1-adamantyl)-2-(dimethylaminooxy)acetamide

N-(1-adamantyl)-2-(dimethylaminooxy)acetamide (PubChem CID 161464424) has the molecular formula C14H24N2O2 and a molecular weight of 252.36 g/mol. Its IUPAC name is N-(1-adamantyl)-2-(dimethylaminooxy)acetamide.

Molecular Properties

Compound NameN-(1-adamantyl)-2-(dimethylaminooxy)acetamide
PubChem CID161464424
Molecular FormulaC14H24N2O2
Molecular Weight252.36 g/mol
Exact Mass252.18
IUPAC NameN-(1-adamantyl)-2-(dimethylaminooxy)acetamide
SMILESCN(C)OCC(=O)NC12CC3CC(CC(C3)C1)C2
InChIInChI=1S/C14H24N2O2/c1-16(2)18-9-13(17)15-14-6-10-3-11(7-14)5-12(4-10)8-14/h10-12H,3-9H2,1-2H3,(H,15,17)
InChIKeyOGFPPKTYXIDKNZ-UHFFFAOYSA-N
XLogP1.56
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-(1-adamantyl)-2-(2-hydroxyphenoxy)acetamide
CID 78773695
[2-(1-adamantylamino)-2-oxoethyl] (E)-pent-2-enoate
CID 8673137
N-(1-adamantyl)-2-(3,5-dimethoxyphenoxy)acetamide
CID 7707186
N,2-bis(1-adamantyl)acetamide
CID 3906383
N-(1-adamantyl)hexanamide
CID 4687392
N-(1-adamantyl)-2-piperidin-4-yloxyacetamide
CID 63876004
N'-(1-adamantyl)-N-methylheptanediamide
CID 90206132
N-(1-adamantyl)nonanamide
CID 4685611
N-(1-adamantyl)-2-[methyl-(1-methylpiperidin-4-yl)amino]acetamide
CID 3948880
[2-(1-adamantylamino)-2-oxoethyl] (2R)-2-phenylsulfanylpropanoate
CID 7806621
N-(1-adamantyl)-3-bromopropanamide;hydrochloride
CID 19855241
4-(1-adamantylamino)-2,2-dimethyl-4-oxobutanoic acid
CID 65297911

Frequently Asked Questions

What is the IUPAC name of N-(1-adamantyl)-2-(dimethylaminooxy)acetamide?
The IUPAC name of N-(1-adamantyl)-2-(dimethylaminooxy)acetamide (CID 161464424) is N-(1-adamantyl)-2-(dimethylaminooxy)acetamide.
What is the SMILES notation for N-(1-adamantyl)-2-(dimethylaminooxy)acetamide?
The canonical SMILES for N-(1-adamantyl)-2-(dimethylaminooxy)acetamide is CN(C)OCC(=O)NC12CC3CC(CC(C3)C1)C2.
What is the InChIKey of N-(1-adamantyl)-2-(dimethylaminooxy)acetamide?
The InChIKey is OGFPPKTYXIDKNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O2/c1-16(2)18-9-13(17)15-14-6-10-3-11(7-14)5-12(4-10)8-14/h10-12H,3-9H2,1-2H3,(H,15,17).
What are the key properties of N-(1-adamantyl)-2-(dimethylaminooxy)acetamide?
N-(1-adamantyl)-2-(dimethylaminooxy)acetamide has a molecular weight of 252.36 g/mol, XLogP of 1.56, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-adamantyl)-2-(dimethylaminooxy)acetamide is sourced from PubChem (CID 161464424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).