2-ethenylcycloocten-1-amine

C10H17N — CID 67050811

IUPAC2-ethenylcycloocten-1-amine
SMILESC=CC1=C(N)CCCCCC1
InChIInChI=1S/C10H17N/c1-2-9-7-5-3-4-6-8-10(9)11/h2H,1,3-8,11H2
InChIKeyGQKRWFPITLSFGU-UHFFFAOYSA-N
MW151.25 g/mol
LogP2.74
Rot. Bonds1

About 2-ethenylcycloocten-1-amine

2-ethenylcycloocten-1-amine (PubChem CID 67050811) has the molecular formula C10H17N and a molecular weight of 151.25 g/mol. Its IUPAC name is 2-ethenylcycloocten-1-amine.

Molecular Properties

Compound Name2-ethenylcycloocten-1-amine
PubChem CID67050811
Molecular FormulaC10H17N
Molecular Weight151.25 g/mol
Exact Mass151.14
IUPAC Name2-ethenylcycloocten-1-amine
SMILESC=CC1=C(N)CCCCCC1
InChIInChI=1S/C10H17N/c1-2-9-7-5-3-4-6-8-10(9)11/h2H,1,3-8,11H2
InChIKeyGQKRWFPITLSFGU-UHFFFAOYSA-N
XLogP2.74
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.25
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-ethenylcycloocten-1-amine?
The IUPAC name of 2-ethenylcycloocten-1-amine (CID 67050811) is 2-ethenylcycloocten-1-amine.
What is the SMILES notation for 2-ethenylcycloocten-1-amine?
The canonical SMILES for 2-ethenylcycloocten-1-amine is C=CC1=C(N)CCCCCC1.
What is the InChIKey of 2-ethenylcycloocten-1-amine?
The InChIKey is GQKRWFPITLSFGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N/c1-2-9-7-5-3-4-6-8-10(9)11/h2H,1,3-8,11H2.
What are the key properties of 2-ethenylcycloocten-1-amine?
2-ethenylcycloocten-1-amine has a molecular weight of 151.25 g/mol, XLogP of 2.74, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethenylcycloocten-1-amine is sourced from PubChem (CID 67050811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).