(1E)-N-ethenylcycloocten-1-amine

C10H17N — CID 67050808

IUPAC(1E)-N-ethenylcycloocten-1-amine
SMILESC=CN/C1=C/CCCCCC1
InChIInChI=1S/C10H17N/c1-2-11-10-8-6-4-3-5-7-9-10/h2,8,11H,1,3-7,9H2/b10-8+
InChIKeyRRUQEDQHUOIEFI-CSKARUKUSA-N
MW151.25 g/mol
LogP2.96
Rot. Bonds2

About (1E)-N-ethenylcycloocten-1-amine

(1E)-N-ethenylcycloocten-1-amine (PubChem CID 67050808) has the molecular formula C10H17N and a molecular weight of 151.25 g/mol. Its IUPAC name is (1E)-N-ethenylcycloocten-1-amine.

Molecular Properties

Compound Name(1E)-N-ethenylcycloocten-1-amine
PubChem CID67050808
Molecular FormulaC10H17N
Molecular Weight151.25 g/mol
Exact Mass151.14
IUPAC Name(1E)-N-ethenylcycloocten-1-amine
SMILESC=CN/C1=C/CCCCCC1
InChIInChI=1S/C10H17N/c1-2-11-10-8-6-4-3-5-7-9-10/h2,8,11H,1,3-7,9H2/b10-8+
InChIKeyRRUQEDQHUOIEFI-CSKARUKUSA-N
XLogP2.96
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.25
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (1E)-N-ethenylcycloocten-1-amine?
The IUPAC name of (1E)-N-ethenylcycloocten-1-amine (CID 67050808) is (1E)-N-ethenylcycloocten-1-amine.
What is the SMILES notation for (1E)-N-ethenylcycloocten-1-amine?
The canonical SMILES for (1E)-N-ethenylcycloocten-1-amine is C=CN/C1=C/CCCCCC1.
What is the InChIKey of (1E)-N-ethenylcycloocten-1-amine?
The InChIKey is RRUQEDQHUOIEFI-CSKARUKUSA-N. The full InChI is InChI=1S/C10H17N/c1-2-11-10-8-6-4-3-5-7-9-10/h2,8,11H,1,3-7,9H2/b10-8+.
What are the key properties of (1E)-N-ethenylcycloocten-1-amine?
(1E)-N-ethenylcycloocten-1-amine has a molecular weight of 151.25 g/mol, XLogP of 2.96, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1E)-N-ethenylcycloocten-1-amine is sourced from PubChem (CID 67050808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).