1-(3-bicyclo[3.1.0]hexanyl)piperidin-2-imine

C11H18N2 — CID 130941270

IUPAC1-(3-bicyclo[3.1.0]hexanyl)piperidin-2-imine
SMILES[H]/N=C1\CCCCN1C1CC2CC2C1
InChIInChI=1S/C11H18N2/c12-11-3-1-2-4-13(11)10-6-8-5-9(8)7-10/h8-10,12H,1-7H2/b12-11+
InChIKeyWRWZOMHCYXNMST-VAWYXSNFSA-N
MW178.28 g/mol
LogP2.25
Rot. Bonds1

About 1-(3-bicyclo[3.1.0]hexanyl)piperidin-2-imine

1-(3-bicyclo[3.1.0]hexanyl)piperidin-2-imine (PubChem CID 130941270) has the molecular formula C11H18N2 and a molecular weight of 178.28 g/mol. Its IUPAC name is 1-(3-bicyclo[3.1.0]hexanyl)piperidin-2-imine.

Molecular Properties

Compound Name1-(3-bicyclo[3.1.0]hexanyl)piperidin-2-imine
PubChem CID130941270
Molecular FormulaC11H18N2
Molecular Weight178.28 g/mol
Exact Mass178.15
IUPAC Name1-(3-bicyclo[3.1.0]hexanyl)piperidin-2-imine
SMILES[H]/N=C1\CCCCN1C1CC2CC2C1
InChIInChI=1S/C11H18N2/c12-11-3-1-2-4-13(11)10-6-8-5-9(8)7-10/h8-10,12H,1-7H2/b12-11+
InChIKeyWRWZOMHCYXNMST-VAWYXSNFSA-N
XLogP2.25
TPSA27.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.28
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-(3-bicyclo[3.1.0]hexanyl)piperidin-2-imine?
The IUPAC name of 1-(3-bicyclo[3.1.0]hexanyl)piperidin-2-imine (CID 130941270) is 1-(3-bicyclo[3.1.0]hexanyl)piperidin-2-imine.
What is the SMILES notation for 1-(3-bicyclo[3.1.0]hexanyl)piperidin-2-imine?
The canonical SMILES for 1-(3-bicyclo[3.1.0]hexanyl)piperidin-2-imine is [H]/N=C1\CCCCN1C1CC2CC2C1.
What is the InChIKey of 1-(3-bicyclo[3.1.0]hexanyl)piperidin-2-imine?
The InChIKey is WRWZOMHCYXNMST-VAWYXSNFSA-N. The full InChI is InChI=1S/C11H18N2/c12-11-3-1-2-4-13(11)10-6-8-5-9(8)7-10/h8-10,12H,1-7H2/b12-11+.
What are the key properties of 1-(3-bicyclo[3.1.0]hexanyl)piperidin-2-imine?
1-(3-bicyclo[3.1.0]hexanyl)piperidin-2-imine has a molecular weight of 178.28 g/mol, XLogP of 2.25, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-bicyclo[3.1.0]hexanyl)piperidin-2-imine is sourced from PubChem (CID 130941270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).