tricyclo[5.3.1.03,8]undecane-3-carboxamide

C12H19NO — CID 516772

IUPACtricyclo[5.3.1.03,8]undecane-3-carboxamide
SMILESNC(=O)C12CCCC3CC(CCC31)C2
InChIInChI=1S/C12H19NO/c13-11(14)12-5-1-2-9-6-8(7-12)3-4-10(9)12/h8-10H,1-7H2,(H2,13,14)
InChIKeyOAXXKHFZMFHVTI-UHFFFAOYSA-N
MW193.29 g/mol
LogP2.08
Rot. Bonds1

About tricyclo[5.3.1.03,8]undecane-3-carboxamide

tricyclo[5.3.1.03,8]undecane-3-carboxamide (PubChem CID 516772) has the molecular formula C12H19NO and a molecular weight of 193.29 g/mol. Its IUPAC name is tricyclo[5.3.1.03,8]undecane-3-carboxamide.

Molecular Properties

Compound Nametricyclo[5.3.1.03,8]undecane-3-carboxamide
PubChem CID516772
Molecular FormulaC12H19NO
Molecular Weight193.29 g/mol
Exact Mass193.15
IUPAC Nametricyclo[5.3.1.03,8]undecane-3-carboxamide
SMILESNC(=O)C12CCCC3CC(CCC31)C2
InChIInChI=1S/C12H19NO/c13-11(14)12-5-1-2-9-6-8(7-12)3-4-10(9)12/h8-10H,1-7H2,(H2,13,14)
InChIKeyOAXXKHFZMFHVTI-UHFFFAOYSA-N
XLogP2.08
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of tricyclo[5.3.1.03,8]undecane-3-carboxamide?
The IUPAC name of tricyclo[5.3.1.03,8]undecane-3-carboxamide (CID 516772) is tricyclo[5.3.1.03,8]undecane-3-carboxamide.
What is the SMILES notation for tricyclo[5.3.1.03,8]undecane-3-carboxamide?
The canonical SMILES for tricyclo[5.3.1.03,8]undecane-3-carboxamide is NC(=O)C12CCCC3CC(CCC31)C2.
What is the InChIKey of tricyclo[5.3.1.03,8]undecane-3-carboxamide?
The InChIKey is OAXXKHFZMFHVTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO/c13-11(14)12-5-1-2-9-6-8(7-12)3-4-10(9)12/h8-10H,1-7H2,(H2,13,14).
What are the key properties of tricyclo[5.3.1.03,8]undecane-3-carboxamide?
tricyclo[5.3.1.03,8]undecane-3-carboxamide has a molecular weight of 193.29 g/mol, XLogP of 2.08, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tricyclo[5.3.1.03,8]undecane-3-carboxamide is sourced from PubChem (CID 516772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).