3-[(1-fluorocyclopropyl)methyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexane

C11H18FN — CID 130621010

IUPAC3-[(1-fluorocyclopropyl)methyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexane
SMILESCC1(C)C2CN(CC3(F)CC3)CC21
InChIInChI=1S/C11H18FN/c1-10(2)8-5-13(6-9(8)10)7-11(12)3-4-11/h8-9H,3-7H2,1-2H3
InChIKeyRHUXIZSOMHRIAN-UHFFFAOYSA-N
MW183.27 g/mol
LogP2.08
Rot. Bonds2

About 3-[(1-fluorocyclopropyl)methyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexane

3-[(1-fluorocyclopropyl)methyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexane (PubChem CID 130621010) has the molecular formula C11H18FN and a molecular weight of 183.27 g/mol. Its IUPAC name is 3-[(1-fluorocyclopropyl)methyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexane.

Molecular Properties

Compound Name3-[(1-fluorocyclopropyl)methyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexane
PubChem CID130621010
Molecular FormulaC11H18FN
Molecular Weight183.27 g/mol
Exact Mass183.14
IUPAC Name3-[(1-fluorocyclopropyl)methyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexane
SMILESCC1(C)C2CN(CC3(F)CC3)CC21
InChIInChI=1S/C11H18FN/c1-10(2)8-5-13(6-9(8)10)7-11(12)3-4-11/h8-9H,3-7H2,1-2H3
InChIKeyRHUXIZSOMHRIAN-UHFFFAOYSA-N
XLogP2.08
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.27
LogP ≤ 52.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 3-[(1-fluorocyclopropyl)methyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexane 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 3-[(1-fluorocyclopropyl)methyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexane?
The IUPAC name of 3-[(1-fluorocyclopropyl)methyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexane (CID 130621010) is 3-[(1-fluorocyclopropyl)methyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexane.
What is the SMILES notation for 3-[(1-fluorocyclopropyl)methyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexane?
The canonical SMILES for 3-[(1-fluorocyclopropyl)methyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexane is CC1(C)C2CN(CC3(F)CC3)CC21.
What is the InChIKey of 3-[(1-fluorocyclopropyl)methyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexane?
The InChIKey is RHUXIZSOMHRIAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18FN/c1-10(2)8-5-13(6-9(8)10)7-11(12)3-4-11/h8-9H,3-7H2,1-2H3.
What are the key properties of 3-[(1-fluorocyclopropyl)methyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexane?
3-[(1-fluorocyclopropyl)methyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexane has a molecular weight of 183.27 g/mol, XLogP of 2.08, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(1-fluorocyclopropyl)methyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexane is sourced from PubChem (CID 130621010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).