3-benzyl-6-phenyl-3-azabicyclo[3.2.0]heptane

C19H21N — CID 19963621

IUPAC3-benzyl-6-phenyl-3-azabicyclo[3.2.0]heptane
SMILESc1ccc(CN2CC3CC(c4ccccc4)C3C2)cc1
InChIInChI=1S/C19H21N/c1-3-7-15(8-4-1)12-20-13-17-11-18(19(17)14-20)16-9-5-2-6-10-16/h1-10,17-19H,11-14H2
InChIKeyZBAUXQDRYYCZQY-UHFFFAOYSA-N
MW263.38 g/mol
LogP3.92
Rot. Bonds3

About 3-benzyl-6-phenyl-3-azabicyclo[3.2.0]heptane

3-benzyl-6-phenyl-3-azabicyclo[3.2.0]heptane (PubChem CID 19963621) has the molecular formula C19H21N and a molecular weight of 263.38 g/mol. Its IUPAC name is 3-benzyl-6-phenyl-3-azabicyclo[3.2.0]heptane.

Molecular Properties

Compound Name3-benzyl-6-phenyl-3-azabicyclo[3.2.0]heptane
PubChem CID19963621
Molecular FormulaC19H21N
Molecular Weight263.38 g/mol
Exact Mass263.17
IUPAC Name3-benzyl-6-phenyl-3-azabicyclo[3.2.0]heptane
SMILESc1ccc(CN2CC3CC(c4ccccc4)C3C2)cc1
InChIInChI=1S/C19H21N/c1-3-7-15(8-4-1)12-20-13-17-11-18(19(17)14-20)16-9-5-2-6-10-16/h1-10,17-19H,11-14H2
InChIKeyZBAUXQDRYYCZQY-UHFFFAOYSA-N
XLogP3.92
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 53.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 3-benzyl-6-phenyl-3-azabicyclo[3.2.0]heptane with MolForge

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

Launch Full Analysis

Related Compounds

1-benzyl-3,4-diphenylpyrrolidine
CID 5136126
(1S,5S)-3-benzyl-3-azabicyclo[3.1.0]hexane
CID 98048046
1-benzyl-4-phenylpyrrolidin-3-ol
CID 12044053
3-benzyl-3-azabicyclo[3.2.0]heptane
CID 70581599
1-benzyl-3-methyl-4-phenylpyrrolidine
CID 3522572
(4S)-1-benzyl-3-methyl-4-phenylpyrrolidine
CID 71104653
1-phenyl-4-(6-phenyl-3-azabicyclo[3.2.0]heptan-3-yl)butan-1-ol
CID 22405844
4-benzyl-4-azatricyclo[5.2.1.02,6]dec-8-ene
CID 15223361
3-benzyl-3-azabicyclo[3.1.1]heptan-6-amine;dihydrochloride
CID 154704150
(4S)-2-benzyl-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-4-amine
CID 71742370
(3aR,6aS)-2-benzyl-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-4-amine
CID 59011511
(3aS,6aR)-5-benzyl-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrol-2-ium
CID 51614151

Frequently Asked Questions

What is the IUPAC name of 3-benzyl-6-phenyl-3-azabicyclo[3.2.0]heptane?
The IUPAC name of 3-benzyl-6-phenyl-3-azabicyclo[3.2.0]heptane (CID 19963621) is 3-benzyl-6-phenyl-3-azabicyclo[3.2.0]heptane.
What is the SMILES notation for 3-benzyl-6-phenyl-3-azabicyclo[3.2.0]heptane?
The canonical SMILES for 3-benzyl-6-phenyl-3-azabicyclo[3.2.0]heptane is c1ccc(CN2CC3CC(c4ccccc4)C3C2)cc1.
What is the InChIKey of 3-benzyl-6-phenyl-3-azabicyclo[3.2.0]heptane?
The InChIKey is ZBAUXQDRYYCZQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N/c1-3-7-15(8-4-1)12-20-13-17-11-18(19(17)14-20)16-9-5-2-6-10-16/h1-10,17-19H,11-14H2.
What are the key properties of 3-benzyl-6-phenyl-3-azabicyclo[3.2.0]heptane?
3-benzyl-6-phenyl-3-azabicyclo[3.2.0]heptane has a molecular weight of 263.38 g/mol, XLogP of 3.92, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-benzyl-6-phenyl-3-azabicyclo[3.2.0]heptane is sourced from PubChem (CID 19963621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).