4-ethylbicyclo[2.2.0]hexan-1-amine

C8H15N — CID 123666480

IUPAC4-ethylbicyclo[2.2.0]hexan-1-amine
SMILESCCC12CCC1(N)CC2
InChIInChI=1S/C8H15N/c1-2-7-3-5-8(7,9)6-4-7/h2-6,9H2,1H3
InChIKeyMZTJLMZCNAPZAI-UHFFFAOYSA-N
MW125.22 g/mol
LogP1.67
Rot. Bonds1

About 4-ethylbicyclo[2.2.0]hexan-1-amine

4-ethylbicyclo[2.2.0]hexan-1-amine (PubChem CID 123666480) has the molecular formula C8H15N and a molecular weight of 125.22 g/mol. Its IUPAC name is 4-ethylbicyclo[2.2.0]hexan-1-amine.

Molecular Properties

Compound Name4-ethylbicyclo[2.2.0]hexan-1-amine
PubChem CID123666480
Molecular FormulaC8H15N
Molecular Weight125.22 g/mol
Exact Mass125.12
IUPAC Name4-ethylbicyclo[2.2.0]hexan-1-amine
SMILESCCC12CCC1(N)CC2
InChIInChI=1S/C8H15N/c1-2-7-3-5-8(7,9)6-4-7/h2-6,9H2,1H3
InChIKeyMZTJLMZCNAPZAI-UHFFFAOYSA-N
XLogP1.67
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500125.22
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-ethylbicyclo[2.2.0]hexan-1-amine?
The IUPAC name of 4-ethylbicyclo[2.2.0]hexan-1-amine (CID 123666480) is 4-ethylbicyclo[2.2.0]hexan-1-amine.
What is the SMILES notation for 4-ethylbicyclo[2.2.0]hexan-1-amine?
The canonical SMILES for 4-ethylbicyclo[2.2.0]hexan-1-amine is CCC12CCC1(N)CC2.
What is the InChIKey of 4-ethylbicyclo[2.2.0]hexan-1-amine?
The InChIKey is MZTJLMZCNAPZAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N/c1-2-7-3-5-8(7,9)6-4-7/h2-6,9H2,1H3.
What are the key properties of 4-ethylbicyclo[2.2.0]hexan-1-amine?
4-ethylbicyclo[2.2.0]hexan-1-amine has a molecular weight of 125.22 g/mol, XLogP of 1.67, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethylbicyclo[2.2.0]hexan-1-amine is sourced from PubChem (CID 123666480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).