2-(3-azabicyclo[3.1.0]hexan-3-yl)-2-cyclopropylethanamine

C10H18N2 — CID 82413998

IUPAC2-(3-azabicyclo[3.1.0]hexan-3-yl)-2-cyclopropylethanamine
SMILESNCC(C1CC1)N1CC2CC2C1
InChIInChI=1S/C10H18N2/c11-4-10(7-1-2-7)12-5-8-3-9(8)6-12/h7-10H,1-6,11H2
InChIKeyBQNCAPBRRIYEEV-UHFFFAOYSA-N
MW166.27 g/mol
LogP0.68
Rot. Bonds3

About 2-(3-azabicyclo[3.1.0]hexan-3-yl)-2-cyclopropylethanamine

2-(3-azabicyclo[3.1.0]hexan-3-yl)-2-cyclopropylethanamine (PubChem CID 82413998) has the molecular formula C10H18N2 and a molecular weight of 166.27 g/mol. Its IUPAC name is 2-(3-azabicyclo[3.1.0]hexan-3-yl)-2-cyclopropylethanamine.

Molecular Properties

Compound Name2-(3-azabicyclo[3.1.0]hexan-3-yl)-2-cyclopropylethanamine
PubChem CID82413998
Molecular FormulaC10H18N2
Molecular Weight166.27 g/mol
Exact Mass166.15
IUPAC Name2-(3-azabicyclo[3.1.0]hexan-3-yl)-2-cyclopropylethanamine
SMILESNCC(C1CC1)N1CC2CC2C1
InChIInChI=1S/C10H18N2/c11-4-10(7-1-2-7)12-5-8-3-9(8)6-12/h7-10H,1-6,11H2
InChIKeyBQNCAPBRRIYEEV-UHFFFAOYSA-N
XLogP0.68
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.27
LogP ≤ 50.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(3-azabicyclo[3.1.0]hexan-3-yl)-2-cyclopropylethanamine?
The IUPAC name of 2-(3-azabicyclo[3.1.0]hexan-3-yl)-2-cyclopropylethanamine (CID 82413998) is 2-(3-azabicyclo[3.1.0]hexan-3-yl)-2-cyclopropylethanamine.
What is the SMILES notation for 2-(3-azabicyclo[3.1.0]hexan-3-yl)-2-cyclopropylethanamine?
The canonical SMILES for 2-(3-azabicyclo[3.1.0]hexan-3-yl)-2-cyclopropylethanamine is NCC(C1CC1)N1CC2CC2C1.
What is the InChIKey of 2-(3-azabicyclo[3.1.0]hexan-3-yl)-2-cyclopropylethanamine?
The InChIKey is BQNCAPBRRIYEEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2/c11-4-10(7-1-2-7)12-5-8-3-9(8)6-12/h7-10H,1-6,11H2.
What are the key properties of 2-(3-azabicyclo[3.1.0]hexan-3-yl)-2-cyclopropylethanamine?
2-(3-azabicyclo[3.1.0]hexan-3-yl)-2-cyclopropylethanamine has a molecular weight of 166.27 g/mol, XLogP of 0.68, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-azabicyclo[3.1.0]hexan-3-yl)-2-cyclopropylethanamine is sourced from PubChem (CID 82413998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).