spiro[2.3]hexan-5-amine

C6H11N — CID 65008282

IUPACspiro[2.3]hexan-5-amine
SMILESNC1CC2(CC2)C1
InChIInChI=1S/C6H11N/c7-5-3-6(4-5)1-2-6/h5H,1-4,7H2
InChIKeySNXLWVHULKWWHJ-UHFFFAOYSA-N
MW97.16 g/mol
LogP0.89
Rot. Bonds

About spiro[2.3]hexan-5-amine

spiro[2.3]hexan-5-amine (PubChem CID 65008282) has the molecular formula C6H11N and a molecular weight of 97.16 g/mol. Its IUPAC name is spiro[2.3]hexan-5-amine.

Molecular Properties

Compound Namespiro[2.3]hexan-5-amine
PubChem CID65008282
Molecular FormulaC6H11N
Molecular Weight97.16 g/mol
Exact Mass97.09
IUPAC Namespiro[2.3]hexan-5-amine
SMILESNC1CC2(CC2)C1
InChIInChI=1S/C6H11N/c7-5-3-6(4-5)1-2-6/h5H,1-4,7H2
InChIKeySNXLWVHULKWWHJ-UHFFFAOYSA-N
XLogP0.89
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 ≤ 50.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of spiro[2.3]hexan-5-amine?
The IUPAC name of spiro[2.3]hexan-5-amine (CID 65008282) is spiro[2.3]hexan-5-amine.
What is the SMILES notation for spiro[2.3]hexan-5-amine?
The canonical SMILES for spiro[2.3]hexan-5-amine is NC1CC2(CC2)C1.
What is the InChIKey of spiro[2.3]hexan-5-amine?
The InChIKey is SNXLWVHULKWWHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N/c7-5-3-6(4-5)1-2-6/h5H,1-4,7H2.
What are the key properties of spiro[2.3]hexan-5-amine?
spiro[2.3]hexan-5-amine has a molecular weight of 97.16 g/mol, XLogP of 0.89, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for spiro[2.3]hexan-5-amine is sourced from PubChem (CID 65008282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).