tricyclo[4.3.1.12,5]undecan-1-amine

C11H19N — CID 18965986

IUPACtricyclo[4.3.1.12,5]undecan-1-amine
SMILESNC12CCCC(C1)C1CCC2C1
InChIInChI=1S/C11H19N/c12-11-5-1-2-9(7-11)8-3-4-10(11)6-8/h8-10H,1-7,12H2
InChIKeyVQNOEPQTZICKCH-UHFFFAOYSA-N
MW165.28 g/mol
LogP2.30
Rot. Bonds

About tricyclo[4.3.1.12,5]undecan-1-amine

tricyclo[4.3.1.12,5]undecan-1-amine (PubChem CID 18965986) has the molecular formula C11H19N and a molecular weight of 165.28 g/mol. Its IUPAC name is tricyclo[4.3.1.12,5]undecan-1-amine.

Molecular Properties

Compound Nametricyclo[4.3.1.12,5]undecan-1-amine
PubChem CID18965986
Molecular FormulaC11H19N
Molecular Weight165.28 g/mol
Exact Mass165.15
IUPAC Nametricyclo[4.3.1.12,5]undecan-1-amine
SMILESNC12CCCC(C1)C1CCC2C1
InChIInChI=1S/C11H19N/c12-11-5-1-2-9(7-11)8-3-4-10(11)6-8/h8-10H,1-7,12H2
InChIKeyVQNOEPQTZICKCH-UHFFFAOYSA-N
XLogP2.30
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.28
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of tricyclo[4.3.1.12,5]undecan-1-amine?
The IUPAC name of tricyclo[4.3.1.12,5]undecan-1-amine (CID 18965986) is tricyclo[4.3.1.12,5]undecan-1-amine.
What is the SMILES notation for tricyclo[4.3.1.12,5]undecan-1-amine?
The canonical SMILES for tricyclo[4.3.1.12,5]undecan-1-amine is NC12CCCC(C1)C1CCC2C1.
What is the InChIKey of tricyclo[4.3.1.12,5]undecan-1-amine?
The InChIKey is VQNOEPQTZICKCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N/c12-11-5-1-2-9(7-11)8-3-4-10(11)6-8/h8-10H,1-7,12H2.
What are the key properties of tricyclo[4.3.1.12,5]undecan-1-amine?
tricyclo[4.3.1.12,5]undecan-1-amine has a molecular weight of 165.28 g/mol, XLogP of 2.30, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tricyclo[4.3.1.12,5]undecan-1-amine is sourced from PubChem (CID 18965986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).