6-bicyclo[3.1.0]hexanyl(cyclobutyl)methanamine

C11H19N — CID 105049389

IUPAC6-bicyclo[3.1.0]hexanyl(cyclobutyl)methanamine
SMILESNC(C1CCC1)C1C2CCCC21
InChIInChI=1S/C11H19N/c12-11(7-3-1-4-7)10-8-5-2-6-9(8)10/h7-11H,1-6,12H2
InChIKeySMDKSRHJGYUCMA-UHFFFAOYSA-N
MW165.28 g/mol
LogP2.16
Rot. Bonds2

About 6-bicyclo[3.1.0]hexanyl(cyclobutyl)methanamine

6-bicyclo[3.1.0]hexanyl(cyclobutyl)methanamine (PubChem CID 105049389) has the molecular formula C11H19N and a molecular weight of 165.28 g/mol. Its IUPAC name is 6-bicyclo[3.1.0]hexanyl(cyclobutyl)methanamine.

Molecular Properties

Compound Name6-bicyclo[3.1.0]hexanyl(cyclobutyl)methanamine
PubChem CID105049389
Molecular FormulaC11H19N
Molecular Weight165.28 g/mol
Exact Mass165.15
IUPAC Name6-bicyclo[3.1.0]hexanyl(cyclobutyl)methanamine
SMILESNC(C1CCC1)C1C2CCCC21
InChIInChI=1S/C11H19N/c12-11(7-3-1-4-7)10-8-5-2-6-9(8)10/h7-11H,1-6,12H2
InChIKeySMDKSRHJGYUCMA-UHFFFAOYSA-N
XLogP2.16
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 ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 6-bicyclo[3.1.0]hexanyl(cyclobutyl)methanamine?
The IUPAC name of 6-bicyclo[3.1.0]hexanyl(cyclobutyl)methanamine (CID 105049389) is 6-bicyclo[3.1.0]hexanyl(cyclobutyl)methanamine.
What is the SMILES notation for 6-bicyclo[3.1.0]hexanyl(cyclobutyl)methanamine?
The canonical SMILES for 6-bicyclo[3.1.0]hexanyl(cyclobutyl)methanamine is NC(C1CCC1)C1C2CCCC21.
What is the InChIKey of 6-bicyclo[3.1.0]hexanyl(cyclobutyl)methanamine?
The InChIKey is SMDKSRHJGYUCMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N/c12-11(7-3-1-4-7)10-8-5-2-6-9(8)10/h7-11H,1-6,12H2.
What are the key properties of 6-bicyclo[3.1.0]hexanyl(cyclobutyl)methanamine?
6-bicyclo[3.1.0]hexanyl(cyclobutyl)methanamine has a molecular weight of 165.28 g/mol, XLogP of 2.16, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bicyclo[3.1.0]hexanyl(cyclobutyl)methanamine is sourced from PubChem (CID 105049389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).