N-ethyl-1-piperidin-3-ylethenamine

C9H18N2 — CID 89054234

IUPACN-ethyl-1-piperidin-3-ylethenamine
SMILESC=C(NCC)C1CCCNC1
InChIInChI=1S/C9H18N2/c1-3-11-8(2)9-5-4-6-10-7-9/h9-11H,2-7H2,1H3
InChIKeyDMYZTYUNIPSRDH-UHFFFAOYSA-N
MW154.26 g/mol
LogP1.11
Rot. Bonds3

About N-ethyl-1-piperidin-3-ylethenamine

N-ethyl-1-piperidin-3-ylethenamine (PubChem CID 89054234) has the molecular formula C9H18N2 and a molecular weight of 154.26 g/mol. Its IUPAC name is N-ethyl-1-piperidin-3-ylethenamine.

Molecular Properties

Compound NameN-ethyl-1-piperidin-3-ylethenamine
PubChem CID89054234
Molecular FormulaC9H18N2
Molecular Weight154.26 g/mol
Exact Mass154.15
IUPAC NameN-ethyl-1-piperidin-3-ylethenamine
SMILESC=C(NCC)C1CCCNC1
InChIInChI=1S/C9H18N2/c1-3-11-8(2)9-5-4-6-10-7-9/h9-11H,2-7H2,1H3
InChIKeyDMYZTYUNIPSRDH-UHFFFAOYSA-N
XLogP1.11
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.26
LogP ≤ 51.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-piperidin-3-ylethenamine?
The IUPAC name of N-ethyl-1-piperidin-3-ylethenamine (CID 89054234) is N-ethyl-1-piperidin-3-ylethenamine.
What is the SMILES notation for N-ethyl-1-piperidin-3-ylethenamine?
The canonical SMILES for N-ethyl-1-piperidin-3-ylethenamine is C=C(NCC)C1CCCNC1.
What is the InChIKey of N-ethyl-1-piperidin-3-ylethenamine?
The InChIKey is DMYZTYUNIPSRDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2/c1-3-11-8(2)9-5-4-6-10-7-9/h9-11H,2-7H2,1H3.
What are the key properties of N-ethyl-1-piperidin-3-ylethenamine?
N-ethyl-1-piperidin-3-ylethenamine has a molecular weight of 154.26 g/mol, XLogP of 1.11, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-piperidin-3-ylethenamine is sourced from PubChem (CID 89054234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).