N-(7-methyl-1-tricyclo[3.3.1.13,7]dec-3-enyl)acetamide

C13H19NO — CID 70323627

IUPACN-(7-methyl-1-tricyclo[3.3.1.13,7]dec-3-enyl)acetamide
SMILESCC(=O)NC12CC3=CC(CC(C)(C3)C1)C2
InChIInChI=1S/C13H19NO/c1-9(15)14-13-6-10-3-11(7-13)5-12(2,4-10)8-13/h3,10H,4-8H2,1-2H3,(H,14,15)
InChIKeyCUKFIXAFGXFXPK-UHFFFAOYSA-N
MW205.30 g/mol
LogP2.40
Rot. Bonds1

About N-(7-methyl-1-tricyclo[3.3.1.13,7]dec-3-enyl)acetamide

N-(7-methyl-1-tricyclo[3.3.1.13,7]dec-3-enyl)acetamide (PubChem CID 70323627) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is N-(7-methyl-1-tricyclo[3.3.1.13,7]dec-3-enyl)acetamide.

Molecular Properties

Compound NameN-(7-methyl-1-tricyclo[3.3.1.13,7]dec-3-enyl)acetamide
PubChem CID70323627
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC NameN-(7-methyl-1-tricyclo[3.3.1.13,7]dec-3-enyl)acetamide
SMILESCC(=O)NC12CC3=CC(CC(C)(C3)C1)C2
InChIInChI=1S/C13H19NO/c1-9(15)14-13-6-10-3-11(7-13)5-12(2,4-10)8-13/h3,10H,4-8H2,1-2H3,(H,14,15)
InChIKeyCUKFIXAFGXFXPK-UHFFFAOYSA-N
XLogP2.40
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(7-methyl-1-tricyclo[3.3.1.13,7]dec-3-enyl)acetamide?
The IUPAC name of N-(7-methyl-1-tricyclo[3.3.1.13,7]dec-3-enyl)acetamide (CID 70323627) is N-(7-methyl-1-tricyclo[3.3.1.13,7]dec-3-enyl)acetamide.
What is the SMILES notation for N-(7-methyl-1-tricyclo[3.3.1.13,7]dec-3-enyl)acetamide?
The canonical SMILES for N-(7-methyl-1-tricyclo[3.3.1.13,7]dec-3-enyl)acetamide is CC(=O)NC12CC3=CC(CC(C)(C3)C1)C2.
What is the InChIKey of N-(7-methyl-1-tricyclo[3.3.1.13,7]dec-3-enyl)acetamide?
The InChIKey is CUKFIXAFGXFXPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO/c1-9(15)14-13-6-10-3-11(7-13)5-12(2,4-10)8-13/h3,10H,4-8H2,1-2H3,(H,14,15).
What are the key properties of N-(7-methyl-1-tricyclo[3.3.1.13,7]dec-3-enyl)acetamide?
N-(7-methyl-1-tricyclo[3.3.1.13,7]dec-3-enyl)acetamide has a molecular weight of 205.30 g/mol, XLogP of 2.40, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(7-methyl-1-tricyclo[3.3.1.13,7]dec-3-enyl)acetamide is sourced from PubChem (CID 70323627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).