N-(2-tricyclo[3.3.1.13,7]dec-5-enyl)acetamide

C12H17NO — CID 122499369

IUPACN-(2-tricyclo[3.3.1.13,7]dec-5-enyl)acetamide
SMILESCC(=O)NC1C2CC3=CC(C2)CC1C3
InChIInChI=1S/C12H17NO/c1-7(14)13-12-10-3-8-2-9(5-10)6-11(12)4-8/h2,8,10-12H,3-6H2,1H3,(H,13,14)
InChIKeyUWWHTOMKSQMYTN-UHFFFAOYSA-N
MW191.27 g/mol
LogP1.87
Rot. Bonds1

About N-(2-tricyclo[3.3.1.13,7]dec-5-enyl)acetamide

N-(2-tricyclo[3.3.1.13,7]dec-5-enyl)acetamide (PubChem CID 122499369) has the molecular formula C12H17NO and a molecular weight of 191.27 g/mol. Its IUPAC name is N-(2-tricyclo[3.3.1.13,7]dec-5-enyl)acetamide.

Molecular Properties

Compound NameN-(2-tricyclo[3.3.1.13,7]dec-5-enyl)acetamide
PubChem CID122499369
Molecular FormulaC12H17NO
Molecular Weight191.27 g/mol
Exact Mass191.13
IUPAC NameN-(2-tricyclo[3.3.1.13,7]dec-5-enyl)acetamide
SMILESCC(=O)NC1C2CC3=CC(C2)CC1C3
InChIInChI=1S/C12H17NO/c1-7(14)13-12-10-3-8-2-9(5-10)6-11(12)4-8/h2,8,10-12H,3-6H2,1H3,(H,13,14)
InChIKeyUWWHTOMKSQMYTN-UHFFFAOYSA-N
XLogP1.87
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.27
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze N-(2-tricyclo[3.3.1.13,7]dec-5-enyl)acetamide 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-(2-adamantyl)-3,7-dimethyloct-6-enamide
CID 162652162
N-(2-adamantyl)-2-[[(2E)-3,7-dimethylocta-2,6-dienyl]amino]acetamide
CID 117951520
2-(2-adamantylamino)-N-[(2E)-3,7-dimethylocta-2,6-dienyl]acetamide
CID 164672395
N-(3-bicyclo[3.3.1]non-6-enyl)acetamide
CID 12444220
N-[(1S,2S,6R)-2,4,6-trimethylcyclohex-3-en-1-yl]acetamide
CID 60076513
N-[(1R,2R,6S)-2,4,6-trimethylcyclohex-3-en-1-yl]acetamide
CID 60076516
N-(2-adamantyl)-N-[(2E)-3,7-dimethylocta-2,6-dienyl]acetamide
CID 67159331
N-(2-adamantyl)-N-(3,7-dimethylocta-2,6-dienyl)acetamide
CID 77234131
N-[2-(cyclohexen-1-yl)cyclohexyl]-2-methylpropanamide
CID 91382224
N-(1-tricyclo[3.3.1.13,7]dec-3-enyl)acetamide
CID 122498972
3-amino-N-(7-ethyl-2-bicyclo[3.3.1]non-6-enyl)propanamide
CID 122499351
N-(2-adamantyl)-2-(3,7-dimethylocta-2,6-dienylamino)acetamide
CID 123169676

Frequently Asked Questions

What is the IUPAC name of N-(2-tricyclo[3.3.1.13,7]dec-5-enyl)acetamide?
The IUPAC name of N-(2-tricyclo[3.3.1.13,7]dec-5-enyl)acetamide (CID 122499369) is N-(2-tricyclo[3.3.1.13,7]dec-5-enyl)acetamide.
What is the SMILES notation for N-(2-tricyclo[3.3.1.13,7]dec-5-enyl)acetamide?
The canonical SMILES for N-(2-tricyclo[3.3.1.13,7]dec-5-enyl)acetamide is CC(=O)NC1C2CC3=CC(C2)CC1C3.
What is the InChIKey of N-(2-tricyclo[3.3.1.13,7]dec-5-enyl)acetamide?
The InChIKey is UWWHTOMKSQMYTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO/c1-7(14)13-12-10-3-8-2-9(5-10)6-11(12)4-8/h2,8,10-12H,3-6H2,1H3,(H,13,14).
What are the key properties of N-(2-tricyclo[3.3.1.13,7]dec-5-enyl)acetamide?
N-(2-tricyclo[3.3.1.13,7]dec-5-enyl)acetamide has a molecular weight of 191.27 g/mol, XLogP of 1.87, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-tricyclo[3.3.1.13,7]dec-5-enyl)acetamide is sourced from PubChem (CID 122499369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).