N-(3-tricyclo[5.3.1.03,8]undecanyl)acetamide

C13H21NO — CID 511453

IUPACN-(3-tricyclo[5.3.1.03,8]undecanyl)acetamide
SMILESCC(=O)NC12CCCC3CC(CCC31)C2
InChIInChI=1S/C13H21NO/c1-9(15)14-13-6-2-3-11-7-10(8-13)4-5-12(11)13/h10-12H,2-8H2,1H3,(H,14,15)
InChIKeyPZLXILFBALVYGT-UHFFFAOYSA-N
MW207.32 g/mol
LogP2.48
Rot. Bonds1

About N-(3-tricyclo[5.3.1.03,8]undecanyl)acetamide

N-(3-tricyclo[5.3.1.03,8]undecanyl)acetamide (PubChem CID 511453) has the molecular formula C13H21NO and a molecular weight of 207.32 g/mol. Its IUPAC name is N-(3-tricyclo[5.3.1.03,8]undecanyl)acetamide.

Molecular Properties

Compound NameN-(3-tricyclo[5.3.1.03,8]undecanyl)acetamide
PubChem CID511453
Molecular FormulaC13H21NO
Molecular Weight207.32 g/mol
Exact Mass207.16
IUPAC NameN-(3-tricyclo[5.3.1.03,8]undecanyl)acetamide
SMILESCC(=O)NC12CCCC3CC(CCC31)C2
InChIInChI=1S/C13H21NO/c1-9(15)14-13-6-2-3-11-7-10(8-13)4-5-12(11)13/h10-12H,2-8H2,1H3,(H,14,15)
InChIKeyPZLXILFBALVYGT-UHFFFAOYSA-N
XLogP2.48
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.32
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-(3-tricyclo[5.3.1.03,8]undecanyl)acetamide?
The IUPAC name of N-(3-tricyclo[5.3.1.03,8]undecanyl)acetamide (CID 511453) is N-(3-tricyclo[5.3.1.03,8]undecanyl)acetamide.
What is the SMILES notation for N-(3-tricyclo[5.3.1.03,8]undecanyl)acetamide?
The canonical SMILES for N-(3-tricyclo[5.3.1.03,8]undecanyl)acetamide is CC(=O)NC12CCCC3CC(CCC31)C2.
What is the InChIKey of N-(3-tricyclo[5.3.1.03,8]undecanyl)acetamide?
The InChIKey is PZLXILFBALVYGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21NO/c1-9(15)14-13-6-2-3-11-7-10(8-13)4-5-12(11)13/h10-12H,2-8H2,1H3,(H,14,15).
What are the key properties of N-(3-tricyclo[5.3.1.03,8]undecanyl)acetamide?
N-(3-tricyclo[5.3.1.03,8]undecanyl)acetamide has a molecular weight of 207.32 g/mol, XLogP of 2.48, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-tricyclo[5.3.1.03,8]undecanyl)acetamide is sourced from PubChem (CID 511453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).