N-methyl-1-(5-tricyclo[5.3.1.03,9]undecanyl)methanamine

C13H23N — CID 89233488

IUPACN-methyl-1-(5-tricyclo[5.3.1.03,9]undecanyl)methanamine
SMILESCNCC1CC2CC3CC(C1)C(C2)C3
InChIInChI=1S/C13H23N/c1-14-8-11-3-9-2-10-5-12(4-9)13(6-10)7-11/h9-14H,2-8H2,1H3
InChIKeyAJGAWBSJUMDTRE-UHFFFAOYSA-N
MW193.33 g/mol
LogP2.67
Rot. Bonds2

About N-methyl-1-(5-tricyclo[5.3.1.03,9]undecanyl)methanamine

N-methyl-1-(5-tricyclo[5.3.1.03,9]undecanyl)methanamine (PubChem CID 89233488) has the molecular formula C13H23N and a molecular weight of 193.33 g/mol. Its IUPAC name is N-methyl-1-(5-tricyclo[5.3.1.03,9]undecanyl)methanamine.

Molecular Properties

Compound NameN-methyl-1-(5-tricyclo[5.3.1.03,9]undecanyl)methanamine
PubChem CID89233488
Molecular FormulaC13H23N
Molecular Weight193.33 g/mol
Exact Mass193.18
IUPAC NameN-methyl-1-(5-tricyclo[5.3.1.03,9]undecanyl)methanamine
SMILESCNCC1CC2CC3CC(C1)C(C2)C3
InChIInChI=1S/C13H23N/c1-14-8-11-3-9-2-10-5-12(4-9)13(6-10)7-11/h9-14H,2-8H2,1H3
InChIKeyAJGAWBSJUMDTRE-UHFFFAOYSA-N
XLogP2.67
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.33
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(5-tricyclo[5.3.1.03,9]undecanyl)methanamine?
The IUPAC name of N-methyl-1-(5-tricyclo[5.3.1.03,9]undecanyl)methanamine (CID 89233488) is N-methyl-1-(5-tricyclo[5.3.1.03,9]undecanyl)methanamine.
What is the SMILES notation for N-methyl-1-(5-tricyclo[5.3.1.03,9]undecanyl)methanamine?
The canonical SMILES for N-methyl-1-(5-tricyclo[5.3.1.03,9]undecanyl)methanamine is CNCC1CC2CC3CC(C1)C(C2)C3.
What is the InChIKey of N-methyl-1-(5-tricyclo[5.3.1.03,9]undecanyl)methanamine?
The InChIKey is AJGAWBSJUMDTRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N/c1-14-8-11-3-9-2-10-5-12(4-9)13(6-10)7-11/h9-14H,2-8H2,1H3.
What are the key properties of N-methyl-1-(5-tricyclo[5.3.1.03,9]undecanyl)methanamine?
N-methyl-1-(5-tricyclo[5.3.1.03,9]undecanyl)methanamine has a molecular weight of 193.33 g/mol, XLogP of 2.67, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(5-tricyclo[5.3.1.03,9]undecanyl)methanamine is sourced from PubChem (CID 89233488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).