bicyclo[3.2.0]heptan-1-amine

C7H13N — CID 148858770

IUPACbicyclo[3.2.0]heptan-1-amine
SMILESNC12CCCC1CC2
InChIInChI=1S/C7H13N/c8-7-4-1-2-6(7)3-5-7/h6H,1-5,8H2
InChIKeyOYXBEPOZEKFGKF-UHFFFAOYSA-N
MW111.19 g/mol
LogP1.28
Rot. Bonds

About bicyclo[3.2.0]heptan-1-amine

bicyclo[3.2.0]heptan-1-amine (PubChem CID 148858770) has the molecular formula C7H13N and a molecular weight of 111.19 g/mol. Its IUPAC name is bicyclo[3.2.0]heptan-1-amine.

Molecular Properties

Compound Namebicyclo[3.2.0]heptan-1-amine
PubChem CID148858770
Molecular FormulaC7H13N
Molecular Weight111.19 g/mol
Exact Mass111.10
IUPAC Namebicyclo[3.2.0]heptan-1-amine
SMILESNC12CCCC1CC2
InChIInChI=1S/C7H13N/c8-7-4-1-2-6(7)3-5-7/h6H,1-5,8H2
InChIKeyOYXBEPOZEKFGKF-UHFFFAOYSA-N
XLogP1.28
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500111.19
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of bicyclo[3.2.0]heptan-1-amine?
The IUPAC name of bicyclo[3.2.0]heptan-1-amine (CID 148858770) is bicyclo[3.2.0]heptan-1-amine.
What is the SMILES notation for bicyclo[3.2.0]heptan-1-amine?
The canonical SMILES for bicyclo[3.2.0]heptan-1-amine is NC12CCCC1CC2.
What is the InChIKey of bicyclo[3.2.0]heptan-1-amine?
The InChIKey is OYXBEPOZEKFGKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13N/c8-7-4-1-2-6(7)3-5-7/h6H,1-5,8H2.
What are the key properties of bicyclo[3.2.0]heptan-1-amine?
bicyclo[3.2.0]heptan-1-amine has a molecular weight of 111.19 g/mol, XLogP of 1.28, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for bicyclo[3.2.0]heptan-1-amine is sourced from PubChem (CID 148858770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).