bicyclo[3.1.0]hexan-2-amine

C6H11N — CID 50989726

IUPACbicyclo[3.1.0]hexan-2-amine
SMILESNC1CCC2CC12
InChIInChI=1S/C6H11N/c7-6-2-1-4-3-5(4)6/h4-6H,1-3,7H2
InChIKeyPVXPMXRWNGMGRF-UHFFFAOYSA-N
MW97.16 g/mol
LogP0.74
Rot. Bonds

About bicyclo[3.1.0]hexan-2-amine

bicyclo[3.1.0]hexan-2-amine (PubChem CID 50989726) has the molecular formula C6H11N and a molecular weight of 97.16 g/mol. Its IUPAC name is bicyclo[3.1.0]hexan-2-amine.

Molecular Properties

Compound Namebicyclo[3.1.0]hexan-2-amine
PubChem CID50989726
Molecular FormulaC6H11N
Molecular Weight97.16 g/mol
Exact Mass97.09
IUPAC Namebicyclo[3.1.0]hexan-2-amine
SMILESNC1CCC2CC12
InChIInChI=1S/C6H11N/c7-6-2-1-4-3-5(4)6/h4-6H,1-3,7H2
InChIKeyPVXPMXRWNGMGRF-UHFFFAOYSA-N
XLogP0.74
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50097.16
LogP ≤ 50.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of bicyclo[3.1.0]hexan-2-amine?
The IUPAC name of bicyclo[3.1.0]hexan-2-amine (CID 50989726) is bicyclo[3.1.0]hexan-2-amine.
What is the SMILES notation for bicyclo[3.1.0]hexan-2-amine?
The canonical SMILES for bicyclo[3.1.0]hexan-2-amine is NC1CCC2CC12.
What is the InChIKey of bicyclo[3.1.0]hexan-2-amine?
The InChIKey is PVXPMXRWNGMGRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N/c7-6-2-1-4-3-5(4)6/h4-6H,1-3,7H2.
What are the key properties of bicyclo[3.1.0]hexan-2-amine?
bicyclo[3.1.0]hexan-2-amine has a molecular weight of 97.16 g/mol, XLogP of 0.74, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for bicyclo[3.1.0]hexan-2-amine is sourced from PubChem (CID 50989726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).