8-phenyl-8-azabicyclo[3.2.1]octan-3-amine

C13H18N2 — CID 62739086

IUPAC8-phenyl-8-azabicyclo[3.2.1]octan-3-amine
SMILESNC1CC2CCC(C1)N2c1ccccc1
InChIInChI=1S/C13H18N2/c14-10-8-12-6-7-13(9-10)15(12)11-4-2-1-3-5-11/h1-5,10,12-13H,6-9,14H2
InChIKeySIWFBPYLJRSYLR-UHFFFAOYSA-N
MW202.30 g/mol
LogP2.15
Rot. Bonds1

About 8-phenyl-8-azabicyclo[3.2.1]octan-3-amine

8-phenyl-8-azabicyclo[3.2.1]octan-3-amine (PubChem CID 62739086) has the molecular formula C13H18N2 and a molecular weight of 202.30 g/mol. Its IUPAC name is 8-phenyl-8-azabicyclo[3.2.1]octan-3-amine.

Molecular Properties

Compound Name8-phenyl-8-azabicyclo[3.2.1]octan-3-amine
PubChem CID62739086
Molecular FormulaC13H18N2
Molecular Weight202.30 g/mol
Exact Mass202.15
IUPAC Name8-phenyl-8-azabicyclo[3.2.1]octan-3-amine
SMILESNC1CC2CCC(C1)N2c1ccccc1
InChIInChI=1S/C13H18N2/c14-10-8-12-6-7-13(9-10)15(12)11-4-2-1-3-5-11/h1-5,10,12-13H,6-9,14H2
InChIKeySIWFBPYLJRSYLR-UHFFFAOYSA-N
XLogP2.15
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.30
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 8-phenyl-8-azabicyclo[3.2.1]octan-3-amine?
The IUPAC name of 8-phenyl-8-azabicyclo[3.2.1]octan-3-amine (CID 62739086) is 8-phenyl-8-azabicyclo[3.2.1]octan-3-amine.
What is the SMILES notation for 8-phenyl-8-azabicyclo[3.2.1]octan-3-amine?
The canonical SMILES for 8-phenyl-8-azabicyclo[3.2.1]octan-3-amine is NC1CC2CCC(C1)N2c1ccccc1.
What is the InChIKey of 8-phenyl-8-azabicyclo[3.2.1]octan-3-amine?
The InChIKey is SIWFBPYLJRSYLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2/c14-10-8-12-6-7-13(9-10)15(12)11-4-2-1-3-5-11/h1-5,10,12-13H,6-9,14H2.
What are the key properties of 8-phenyl-8-azabicyclo[3.2.1]octan-3-amine?
8-phenyl-8-azabicyclo[3.2.1]octan-3-amine has a molecular weight of 202.30 g/mol, XLogP of 2.15, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-phenyl-8-azabicyclo[3.2.1]octan-3-amine is sourced from PubChem (CID 62739086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).