N-(2-adamantyl)-2,2-dimethylpropanamide

C15H25NO — CID 768191

IUPACN-(2-adamantyl)-2,2-dimethylpropanamide
SMILESCC(C)(C)C(=O)NC1C2CC3CC(C2)CC1C3
InChIInChI=1S/C15H25NO/c1-15(2,3)14(17)16-13-11-5-9-4-10(7-11)8-12(13)6-9/h9-13H,4-8H2,1-3H3,(H,16,17)
InChIKeySLRWECGOKGKXRS-UHFFFAOYSA-N
MW235.37 g/mol
LogP2.97
Rot. Bonds1

About N-(2-adamantyl)-2,2-dimethylpropanamide

N-(2-adamantyl)-2,2-dimethylpropanamide (PubChem CID 768191) has the molecular formula C15H25NO and a molecular weight of 235.37 g/mol. Its IUPAC name is N-(2-adamantyl)-2,2-dimethylpropanamide.

Molecular Properties

Compound NameN-(2-adamantyl)-2,2-dimethylpropanamide
PubChem CID768191
Molecular FormulaC15H25NO
Molecular Weight235.37 g/mol
Exact Mass235.19
IUPAC NameN-(2-adamantyl)-2,2-dimethylpropanamide
SMILESCC(C)(C)C(=O)NC1C2CC3CC(C2)CC1C3
InChIInChI=1S/C15H25NO/c1-15(2,3)14(17)16-13-11-5-9-4-10(7-11)8-12(13)6-9/h9-13H,4-8H2,1-3H3,(H,16,17)
InChIKeySLRWECGOKGKXRS-UHFFFAOYSA-N
XLogP2.97
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.37
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-(2-adamantyl)-2,2-dimethylpropanamide?
The IUPAC name of N-(2-adamantyl)-2,2-dimethylpropanamide (CID 768191) is N-(2-adamantyl)-2,2-dimethylpropanamide.
What is the SMILES notation for N-(2-adamantyl)-2,2-dimethylpropanamide?
The canonical SMILES for N-(2-adamantyl)-2,2-dimethylpropanamide is CC(C)(C)C(=O)NC1C2CC3CC(C2)CC1C3.
What is the InChIKey of N-(2-adamantyl)-2,2-dimethylpropanamide?
The InChIKey is SLRWECGOKGKXRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO/c1-15(2,3)14(17)16-13-11-5-9-4-10(7-11)8-12(13)6-9/h9-13H,4-8H2,1-3H3,(H,16,17).
What are the key properties of N-(2-adamantyl)-2,2-dimethylpropanamide?
N-(2-adamantyl)-2,2-dimethylpropanamide has a molecular weight of 235.37 g/mol, XLogP of 2.97, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-adamantyl)-2,2-dimethylpropanamide is sourced from PubChem (CID 768191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).