(4-ethyl-4-tricyclo[3.2.1.03,6]octanyl)methanamine

C11H19N — CID 157232882

IUPAC(4-ethyl-4-tricyclo[3.2.1.03,6]octanyl)methanamine
SMILESCCC1(CN)C2CC3CC2C1C3
InChIInChI=1S/C11H19N/c1-2-11(6-12)9-4-7-3-8(9)10(11)5-7/h7-10H,2-6,12H2,1H3
InChIKeyMHULTDDMNVOXCO-UHFFFAOYSA-N
MW165.28 g/mol
LogP2.02
Rot. Bonds2

About (4-ethyl-4-tricyclo[3.2.1.03,6]octanyl)methanamine

(4-ethyl-4-tricyclo[3.2.1.03,6]octanyl)methanamine (PubChem CID 157232882) has the molecular formula C11H19N and a molecular weight of 165.28 g/mol. Its IUPAC name is (4-ethyl-4-tricyclo[3.2.1.03,6]octanyl)methanamine.

Molecular Properties

Compound Name(4-ethyl-4-tricyclo[3.2.1.03,6]octanyl)methanamine
PubChem CID157232882
Molecular FormulaC11H19N
Molecular Weight165.28 g/mol
Exact Mass165.15
IUPAC Name(4-ethyl-4-tricyclo[3.2.1.03,6]octanyl)methanamine
SMILESCCC1(CN)C2CC3CC2C1C3
InChIInChI=1S/C11H19N/c1-2-11(6-12)9-4-7-3-8(9)10(11)5-7/h7-10H,2-6,12H2,1H3
InChIKeyMHULTDDMNVOXCO-UHFFFAOYSA-N
XLogP2.02
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.28
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze (4-ethyl-4-tricyclo[3.2.1.03,6]octanyl)methanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (4-ethyl-4-tricyclo[3.2.1.03,6]octanyl)methanamine?
The IUPAC name of (4-ethyl-4-tricyclo[3.2.1.03,6]octanyl)methanamine (CID 157232882) is (4-ethyl-4-tricyclo[3.2.1.03,6]octanyl)methanamine.
What is the SMILES notation for (4-ethyl-4-tricyclo[3.2.1.03,6]octanyl)methanamine?
The canonical SMILES for (4-ethyl-4-tricyclo[3.2.1.03,6]octanyl)methanamine is CCC1(CN)C2CC3CC2C1C3.
What is the InChIKey of (4-ethyl-4-tricyclo[3.2.1.03,6]octanyl)methanamine?
The InChIKey is MHULTDDMNVOXCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N/c1-2-11(6-12)9-4-7-3-8(9)10(11)5-7/h7-10H,2-6,12H2,1H3.
What are the key properties of (4-ethyl-4-tricyclo[3.2.1.03,6]octanyl)methanamine?
(4-ethyl-4-tricyclo[3.2.1.03,6]octanyl)methanamine has a molecular weight of 165.28 g/mol, XLogP of 2.02, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4-ethyl-4-tricyclo[3.2.1.03,6]octanyl)methanamine is sourced from PubChem (CID 157232882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).