N-(1-adamantyl)-N'-methyl-N'-phenyloxamide

C19H24N2O2 — CID 108520987

IUPACN-(1-adamantyl)-N'-methyl-N'-phenyloxamide
SMILESCN(C(=O)C(=O)NC12CC3CC(CC(C3)C1)C2)c1ccccc1
InChIInChI=1S/C19H24N2O2/c1-21(16-5-3-2-4-6-16)18(23)17(22)20-19-10-13-7-14(11-19)9-15(8-13)12-19/h2-6,13-15H,7-12H2,1H3,(H,20,22)
InChIKeyLCMXAZCXMIODLV-UHFFFAOYSA-N
MW312.41 g/mol
LogP2.73
Rot. Bonds2

About N-(1-adamantyl)-N'-methyl-N'-phenyloxamide

N-(1-adamantyl)-N'-methyl-N'-phenyloxamide (PubChem CID 108520987) has the molecular formula C19H24N2O2 and a molecular weight of 312.41 g/mol. Its IUPAC name is N-(1-adamantyl)-N'-methyl-N'-phenyloxamide.

Molecular Properties

Compound NameN-(1-adamantyl)-N'-methyl-N'-phenyloxamide
PubChem CID108520987
Molecular FormulaC19H24N2O2
Molecular Weight312.41 g/mol
Exact Mass312.18
IUPAC NameN-(1-adamantyl)-N'-methyl-N'-phenyloxamide
SMILESCN(C(=O)C(=O)NC12CC3CC(CC(C3)C1)C2)c1ccccc1
InChIInChI=1S/C19H24N2O2/c1-21(16-5-3-2-4-6-16)18(23)17(22)20-19-10-13-7-14(11-19)9-15(8-13)12-19/h2-6,13-15H,7-12H2,1H3,(H,20,22)
InChIKeyLCMXAZCXMIODLV-UHFFFAOYSA-N
XLogP2.73
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.41
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}

Analyze N-(1-adamantyl)-N'-methyl-N'-phenyloxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N'-(1-adamantyl)-N-[4-(dimethylamino)phenyl]oxamide
CID 108527915
N-(1-adamantyl)-2-[benzyl(methyl)amino]acetamide
CID 3556406
N-(1-adamantyl)-2,2-diphenylpropanamide
CID 10737199
N-(1-adamantyl)-2-[N-(2-hydroxyethyl)anilino]acetamide
CID 658181
N-(1-adamantyl)-4-oxo-4-[2-[4-oxo-4-(N-phenylanilino)butanoyl]hydrazinyl]butanamide
CID 3992740
(2R)-N-(1-adamantylcarbamoyl)-2-[benzyl(methyl)amino]propanamide
CID 9346080
[3-[methyl(phenyl)carbamoyl]oxy-1-adamantyl] N-methyl-N-phenylcarbamate
CID 118583406
1-methyl-3-(2-methyl-2-bicyclo[2.2.1]heptanyl)-1-phenylurea
CID 13474871
N-(2-fluorophenyl)-N'-methyl-N'-phenyloxamide
CID 108520782
N-(1-adamantyl)-2-phenylcyclopropane-1-carboxamide
CID 3328396
ethyl 2-[[2-(1-adamantylamino)-2-oxoacetyl]amino]benzoate
CID 108501905
N-[1-(1-adamantylamino)-1-oxopropan-2-yl]benzamide
CID 146122763

Frequently Asked Questions

What is the IUPAC name of N-(1-adamantyl)-N'-methyl-N'-phenyloxamide?
The IUPAC name of N-(1-adamantyl)-N'-methyl-N'-phenyloxamide (CID 108520987) is N-(1-adamantyl)-N'-methyl-N'-phenyloxamide.
What is the SMILES notation for N-(1-adamantyl)-N'-methyl-N'-phenyloxamide?
The canonical SMILES for N-(1-adamantyl)-N'-methyl-N'-phenyloxamide is CN(C(=O)C(=O)NC12CC3CC(CC(C3)C1)C2)c1ccccc1.
What is the InChIKey of N-(1-adamantyl)-N'-methyl-N'-phenyloxamide?
The InChIKey is LCMXAZCXMIODLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O2/c1-21(16-5-3-2-4-6-16)18(23)17(22)20-19-10-13-7-14(11-19)9-15(8-13)12-19/h2-6,13-15H,7-12H2,1H3,(H,20,22).
What are the key properties of N-(1-adamantyl)-N'-methyl-N'-phenyloxamide?
N-(1-adamantyl)-N'-methyl-N'-phenyloxamide has a molecular weight of 312.41 g/mol, XLogP of 2.73, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-adamantyl)-N'-methyl-N'-phenyloxamide is sourced from PubChem (CID 108520987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).