(3R)-tricyclo[2.2.1.02,6]heptan-3-amine

C7H11N — CID 101101886

IUPAC(3R)-tricyclo[2.2.1.02,6]heptan-3-amine
SMILESN[C@@H]1C2CC3C(C2)C31
InChIInChI=1S/C7H11N/c8-7-3-1-4-5(2-3)6(4)7/h3-7H,1-2,8H2/t3?,4?,5?,6?,7-/m1/s1
InChIKeyLQOHITYZFHUZFZ-SYRNTQKJSA-N
MW109.17 g/mol
LogP0.60
Rot. Bonds

About (3R)-tricyclo[2.2.1.02,6]heptan-3-amine

(3R)-tricyclo[2.2.1.02,6]heptan-3-amine (PubChem CID 101101886) has the molecular formula C7H11N and a molecular weight of 109.17 g/mol. Its IUPAC name is (3R)-tricyclo[2.2.1.02,6]heptan-3-amine.

Molecular Properties

Compound Name(3R)-tricyclo[2.2.1.02,6]heptan-3-amine
PubChem CID101101886
Molecular FormulaC7H11N
Molecular Weight109.17 g/mol
Exact Mass109.09
IUPAC Name(3R)-tricyclo[2.2.1.02,6]heptan-3-amine
SMILESN[C@@H]1C2CC3C(C2)C31
InChIInChI=1S/C7H11N/c8-7-3-1-4-5(2-3)6(4)7/h3-7H,1-2,8H2/t3?,4?,5?,6?,7-/m1/s1
InChIKeyLQOHITYZFHUZFZ-SYRNTQKJSA-N
XLogP0.60
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500109.17
LogP ≤ 50.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (3R)-tricyclo[2.2.1.02,6]heptan-3-amine?
The IUPAC name of (3R)-tricyclo[2.2.1.02,6]heptan-3-amine (CID 101101886) is (3R)-tricyclo[2.2.1.02,6]heptan-3-amine.
What is the SMILES notation for (3R)-tricyclo[2.2.1.02,6]heptan-3-amine?
The canonical SMILES for (3R)-tricyclo[2.2.1.02,6]heptan-3-amine is N[C@@H]1C2CC3C(C2)C31.
What is the InChIKey of (3R)-tricyclo[2.2.1.02,6]heptan-3-amine?
The InChIKey is LQOHITYZFHUZFZ-SYRNTQKJSA-N. The full InChI is InChI=1S/C7H11N/c8-7-3-1-4-5(2-3)6(4)7/h3-7H,1-2,8H2/t3?,4?,5?,6?,7-/m1/s1.
What are the key properties of (3R)-tricyclo[2.2.1.02,6]heptan-3-amine?
(3R)-tricyclo[2.2.1.02,6]heptan-3-amine has a molecular weight of 109.17 g/mol, XLogP of 0.60, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-tricyclo[2.2.1.02,6]heptan-3-amine is sourced from PubChem (CID 101101886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).