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

C19H25NO — CID 5151658

IUPAC2-(1-adamantyl)-N-(2-methylphenyl)acetamide
SMILESCc1ccccc1NC(=O)CC12CC3CC(CC(C3)C1)C2
InChIInChI=1S/C19H25NO/c1-13-4-2-3-5-17(13)20-18(21)12-19-9-14-6-15(10-19)8-16(7-14)11-19/h2-5,14-16H,6-12H2,1H3,(H,20,21)
InChIKeyGUARIIIAASFTLE-UHFFFAOYSA-N
MW283.41 g/mol
LogP4.54
Rot. Bonds3

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

2-(1-adamantyl)-N-(2-methylphenyl)acetamide (PubChem CID 5151658) has the molecular formula C19H25NO and a molecular weight of 283.41 g/mol. Its IUPAC name is 2-(1-adamantyl)-N-(2-methylphenyl)acetamide.

Molecular Properties

Compound Name2-(1-adamantyl)-N-(2-methylphenyl)acetamide
PubChem CID5151658
Molecular FormulaC19H25NO
Molecular Weight283.41 g/mol
Exact Mass283.19
IUPAC Name2-(1-adamantyl)-N-(2-methylphenyl)acetamide
SMILESCc1ccccc1NC(=O)CC12CC3CC(CC(C3)C1)C2
InChIInChI=1S/C19H25NO/c1-13-4-2-3-5-17(13)20-18(21)12-19-9-14-6-15(10-19)8-16(7-14)11-19/h2-5,14-16H,6-12H2,1H3,(H,20,21)
InChIKeyGUARIIIAASFTLE-UHFFFAOYSA-N
XLogP4.54
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.41
LogP ≤ 54.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

Propanamide, N-(3-methylphenyl)-3-phenyl-
CID 532827
(2S,5R)-N-(4-(2-amino-2-oxoethyl)phenyl)-5-methyl-2-(propan-2-yl)cyclohexanecarboxamide
CID 67096018
N-(2-Methylphenyl)benzeneacetamide
CID 38661
2,2-Diphenylacetanilide
CID 252606
N-(3-nitrophenyl)adamantane-1-carboxamide
CID 532255
N-(2,3-dimethylphenyl)-3-phenylpropanamide
CID 795944
N-(2,3-dimethylphenyl)-2-phenylcyclopropanecarboxamide
CID 2933462
N-phenyl-2-(4-phenylphenyl)acetamide
CID 4852740
N-(2,6-Diisopropyl-phenyl)-3-oxo-4,4-diphenyl-butyramide
CID 10476844
Upcmld05admt002042
CID 316235
N-[3-(trifluoromethyl)phenyl]adamantane-1-carboxamide
CID 331255
(alphaE)-N-Phenyl-alpha-(phenylmethylene)benzeneacetamide
CID 1339487

Frequently Asked Questions

What is the IUPAC name of 2-(1-adamantyl)-N-(2-methylphenyl)acetamide?
The IUPAC name of 2-(1-adamantyl)-N-(2-methylphenyl)acetamide (CID 5151658) is 2-(1-adamantyl)-N-(2-methylphenyl)acetamide.
What is the SMILES notation for 2-(1-adamantyl)-N-(2-methylphenyl)acetamide?
The canonical SMILES for 2-(1-adamantyl)-N-(2-methylphenyl)acetamide is Cc1ccccc1NC(=O)CC12CC3CC(CC(C3)C1)C2.
What is the InChIKey of 2-(1-adamantyl)-N-(2-methylphenyl)acetamide?
The InChIKey is GUARIIIAASFTLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25NO/c1-13-4-2-3-5-17(13)20-18(21)12-19-9-14-6-15(10-19)8-16(7-14)11-19/h2-5,14-16H,6-12H2,1H3,(H,20,21).
What are the key properties of 2-(1-adamantyl)-N-(2-methylphenyl)acetamide?
2-(1-adamantyl)-N-(2-methylphenyl)acetamide has a molecular weight of 283.41 g/mol, XLogP of 4.54, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-adamantyl)-N-(2-methylphenyl)acetamide is sourced from PubChem (CID 5151658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).