2-(1-adamantyl)-N-pyridin-4-ylacetamide

C17H22N2O — CID 2971527

IUPAC2-(1-adamantyl)-N-pyridin-4-ylacetamide
SMILESO=C(CC12CC3CC(CC(C3)C1)C2)Nc1ccncc1
InChIInChI=1S/C17H22N2O/c20-16(19-15-1-3-18-4-2-15)11-17-8-12-5-13(9-17)7-14(6-12)10-17/h1-4,12-14H,5-11H2,(H,18,19,20)
InChIKeyGNHIFHKOLFXIPL-UHFFFAOYSA-N
MW270.38 g/mol
LogP3.63
Rot. Bonds3

About 2-(1-adamantyl)-N-pyridin-4-ylacetamide

2-(1-adamantyl)-N-pyridin-4-ylacetamide (PubChem CID 2971527) has the molecular formula C17H22N2O and a molecular weight of 270.38 g/mol. Its IUPAC name is 2-(1-adamantyl)-N-pyridin-4-ylacetamide.

Molecular Properties

Compound Name2-(1-adamantyl)-N-pyridin-4-ylacetamide
PubChem CID2971527
Molecular FormulaC17H22N2O
Molecular Weight270.38 g/mol
Exact Mass270.17
IUPAC Name2-(1-adamantyl)-N-pyridin-4-ylacetamide
SMILESO=C(CC12CC3CC(CC(C3)C1)C2)Nc1ccncc1
InChIInChI=1S/C17H22N2O/c20-16(19-15-1-3-18-4-2-15)11-17-8-12-5-13(9-17)7-14(6-12)10-17/h1-4,12-14H,5-11H2,(H,18,19,20)
InChIKeyGNHIFHKOLFXIPL-UHFFFAOYSA-N
XLogP3.63
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.38
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-(1-adamantyl)-N-pyridin-4-ylacetamide 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

2-(1-adamantyl)-N-(4-aminophenyl)acetamide
CID 79987888
2-(1-adamantyl)-N-(3,5-dichlorophenyl)acetamide
CID 3436472
2-(1-adamantyl)-N-(2,6-dihydroxyphenyl)acetamide
CID 139249629
2-(1-adamantyl)-N-[4-(2-pyridin-2-ylethyl)phenyl]acetamide
CID 46786313
2-(1-adamantyl)-N-(3-ethylphenyl)acetamide
CID 7935228
2-(1-adamantyl)-N-[4-(4-chlorophenoxy)phenyl]acetamide
CID 3621040
2-(1-adamantyl)-N-(4-morpholin-4-ylphenyl)acetamide
CID 3158011
2-(1-adamantyl)-N-(3-methylsulfanylphenyl)acetamide
CID 7734007
2-(1-adamantyl)-N-(2,6-difluorophenyl)acetamide
CID 2741131
2-(1-adamantyl)-N-(3-methylsulfonylphenyl)acetamide
CID 17486752
N-[[4-[[2-(1-adamantyl)acetyl]amino]phenyl]methyl]-2,2,2-trifluoroacetamide
CID 108933649
2-(1-adamantyl)-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]acetamide
CID 25035445

Frequently Asked Questions

What is the IUPAC name of 2-(1-adamantyl)-N-pyridin-4-ylacetamide?
The IUPAC name of 2-(1-adamantyl)-N-pyridin-4-ylacetamide (CID 2971527) is 2-(1-adamantyl)-N-pyridin-4-ylacetamide.
What is the SMILES notation for 2-(1-adamantyl)-N-pyridin-4-ylacetamide?
The canonical SMILES for 2-(1-adamantyl)-N-pyridin-4-ylacetamide is O=C(CC12CC3CC(CC(C3)C1)C2)Nc1ccncc1.
What is the InChIKey of 2-(1-adamantyl)-N-pyridin-4-ylacetamide?
The InChIKey is GNHIFHKOLFXIPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O/c20-16(19-15-1-3-18-4-2-15)11-17-8-12-5-13(9-17)7-14(6-12)10-17/h1-4,12-14H,5-11H2,(H,18,19,20).
What are the key properties of 2-(1-adamantyl)-N-pyridin-4-ylacetamide?
2-(1-adamantyl)-N-pyridin-4-ylacetamide has a molecular weight of 270.38 g/mol, XLogP of 3.63, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-adamantyl)-N-pyridin-4-ylacetamide is sourced from PubChem (CID 2971527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).