N-ethyl-N-[(6-methyl-2-pyridinyl)methyl]ethanamine

C11H18N2 — CID 20791724

IUPACN-ethyl-N-[(6-methyl-2-pyridinyl)methyl]ethanamine
SMILESCCN(CC)Cc1cccc(C)n1
InChIInChI=1S/C11H18N2/c1-4-13(5-2)9-11-8-6-7-10(3)12-11/h6-8H,4-5,9H2,1-3H3
InChIKeyKLYJUPGQIQTMNU-UHFFFAOYSA-N
MW178.28 g/mol
LogP2.23
Rot. Bonds4

About N-ethyl-N-[(6-methyl-2-pyridinyl)methyl]ethanamine

N-ethyl-N-[(6-methyl-2-pyridinyl)methyl]ethanamine (PubChem CID 20791724) has the molecular formula C11H18N2 and a molecular weight of 178.28 g/mol. Its IUPAC name is N-ethyl-N-[(6-methyl-2-pyridinyl)methyl]ethanamine.

Molecular Properties

Compound NameN-ethyl-N-[(6-methyl-2-pyridinyl)methyl]ethanamine
PubChem CID20791724
Molecular FormulaC11H18N2
Molecular Weight178.28 g/mol
Exact Mass178.15
IUPAC NameN-ethyl-N-[(6-methyl-2-pyridinyl)methyl]ethanamine
SMILESCCN(CC)Cc1cccc(C)n1
InChIInChI=1S/C11H18N2/c1-4-13(5-2)9-11-8-6-7-10(3)12-11/h6-8H,4-5,9H2,1-3H3
InChIKeyKLYJUPGQIQTMNU-UHFFFAOYSA-N
XLogP2.23
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.28
LogP ≤ 52.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-[(6-methyl-2-pyridinyl)methyl]ethanamine?
The IUPAC name of N-ethyl-N-[(6-methyl-2-pyridinyl)methyl]ethanamine (CID 20791724) is N-ethyl-N-[(6-methyl-2-pyridinyl)methyl]ethanamine.
What is the SMILES notation for N-ethyl-N-[(6-methyl-2-pyridinyl)methyl]ethanamine?
The canonical SMILES for N-ethyl-N-[(6-methyl-2-pyridinyl)methyl]ethanamine is CCN(CC)Cc1cccc(C)n1.
What is the InChIKey of N-ethyl-N-[(6-methyl-2-pyridinyl)methyl]ethanamine?
The InChIKey is KLYJUPGQIQTMNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2/c1-4-13(5-2)9-11-8-6-7-10(3)12-11/h6-8H,4-5,9H2,1-3H3.
What are the key properties of N-ethyl-N-[(6-methyl-2-pyridinyl)methyl]ethanamine?
N-ethyl-N-[(6-methyl-2-pyridinyl)methyl]ethanamine has a molecular weight of 178.28 g/mol, XLogP of 2.23, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-[(6-methyl-2-pyridinyl)methyl]ethanamine is sourced from PubChem (CID 20791724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).