N-ethyl-2-(5-methyl-3-pyridinyl)ethanamine

C10H16N2 — CID 115375184

IUPACN-ethyl-2-(5-methyl-3-pyridinyl)ethanamine
SMILESCCNCCc1cncc(C)c1
InChIInChI=1S/C10H16N2/c1-3-11-5-4-10-6-9(2)7-12-8-10/h6-8,11H,3-5H2,1-2H3
InChIKeyWXPBZCDBQDCZHG-UHFFFAOYSA-N
MW164.25 g/mol
LogP1.54
Rot. Bonds4

About N-ethyl-2-(5-methyl-3-pyridinyl)ethanamine

N-ethyl-2-(5-methyl-3-pyridinyl)ethanamine (PubChem CID 115375184) has the molecular formula C10H16N2 and a molecular weight of 164.25 g/mol. Its IUPAC name is N-ethyl-2-(5-methyl-3-pyridinyl)ethanamine.

Molecular Properties

Compound NameN-ethyl-2-(5-methyl-3-pyridinyl)ethanamine
PubChem CID115375184
Molecular FormulaC10H16N2
Molecular Weight164.25 g/mol
Exact Mass164.13
IUPAC NameN-ethyl-2-(5-methyl-3-pyridinyl)ethanamine
SMILESCCNCCc1cncc(C)c1
InChIInChI=1S/C10H16N2/c1-3-11-5-4-10-6-9(2)7-12-8-10/h6-8,11H,3-5H2,1-2H3
InChIKeyWXPBZCDBQDCZHG-UHFFFAOYSA-N
XLogP1.54
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.25
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(5-methyl-3-pyridinyl)ethanamine?
The IUPAC name of N-ethyl-2-(5-methyl-3-pyridinyl)ethanamine (CID 115375184) is N-ethyl-2-(5-methyl-3-pyridinyl)ethanamine.
What is the SMILES notation for N-ethyl-2-(5-methyl-3-pyridinyl)ethanamine?
The canonical SMILES for N-ethyl-2-(5-methyl-3-pyridinyl)ethanamine is CCNCCc1cncc(C)c1.
What is the InChIKey of N-ethyl-2-(5-methyl-3-pyridinyl)ethanamine?
The InChIKey is WXPBZCDBQDCZHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2/c1-3-11-5-4-10-6-9(2)7-12-8-10/h6-8,11H,3-5H2,1-2H3.
What are the key properties of N-ethyl-2-(5-methyl-3-pyridinyl)ethanamine?
N-ethyl-2-(5-methyl-3-pyridinyl)ethanamine has a molecular weight of 164.25 g/mol, XLogP of 1.54, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(5-methyl-3-pyridinyl)ethanamine is sourced from PubChem (CID 115375184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).