N-[(5-ethoxy-2-pyridinyl)methyl]ethanamine

C10H16N2O — CID 79775704

IUPACN-[(5-ethoxy-2-pyridinyl)methyl]ethanamine
SMILESCCNCc1ccc(OCC)cn1
InChIInChI=1S/C10H16N2O/c1-3-11-7-9-5-6-10(8-12-9)13-4-2/h5-6,8,11H,3-4,7H2,1-2H3
InChIKeyYIYNEOMITIHTEF-UHFFFAOYSA-N
MW180.25 g/mol
LogP1.59
Rot. Bonds5

About N-[(5-ethoxy-2-pyridinyl)methyl]ethanamine

N-[(5-ethoxy-2-pyridinyl)methyl]ethanamine (PubChem CID 79775704) has the molecular formula C10H16N2O and a molecular weight of 180.25 g/mol. Its IUPAC name is N-[(5-ethoxy-2-pyridinyl)methyl]ethanamine.

Molecular Properties

Compound NameN-[(5-ethoxy-2-pyridinyl)methyl]ethanamine
PubChem CID79775704
Molecular FormulaC10H16N2O
Molecular Weight180.25 g/mol
Exact Mass180.13
IUPAC NameN-[(5-ethoxy-2-pyridinyl)methyl]ethanamine
SMILESCCNCc1ccc(OCC)cn1
InChIInChI=1S/C10H16N2O/c1-3-11-7-9-5-6-10(8-12-9)13-4-2/h5-6,8,11H,3-4,7H2,1-2H3
InChIKeyYIYNEOMITIHTEF-UHFFFAOYSA-N
XLogP1.59
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.25
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[5-(2-fluoroethoxy)-2-pyridinyl]methyl]ethanamine
CID 80700229
N-[[5-(2-phenoxyethoxy)-2-pyridinyl]methyl]ethanamine
CID 79775994
4-[[6-(ethylaminomethyl)-3-pyridinyl]oxy]butan-1-ol
CID 79776524
2-[[6-(ethylaminomethyl)-3-pyridinyl]oxy]-N,N-dimethylethanamine
CID 79776683
N-[[5-[(3,5-difluorophenyl)methoxy]-2-pyridinyl]methyl]ethanamine
CID 105402630
N-[(5-ethoxy-2-pyridinyl)methyl]cyclopropanamine
CID 79782890
N-[[5-(2-pyrrolidin-1-ylethoxy)-2-pyridinyl]methyl]ethanamine
CID 79776328
N-[[5-(pyridin-3-ylmethoxy)-2-pyridinyl]methyl]ethanamine
CID 79775715
N-[(5-but-3-en-2-yloxy-2-pyridinyl)methyl]ethanamine
CID 79775993
ethyl 2-[[6-(ethylaminomethyl)-3-pyridinyl]oxy]pentanoate
CID 83038413
2-[[6-(ethylaminomethyl)-3-pyridinyl]oxy]-1-pyrrolidin-1-ylethanone
CID 79775446
2-[[6-(propylaminomethyl)-3-pyridinyl]oxy]ethanol
CID 79782983

Frequently Asked Questions

What is the IUPAC name of N-[(5-ethoxy-2-pyridinyl)methyl]ethanamine?
The IUPAC name of N-[(5-ethoxy-2-pyridinyl)methyl]ethanamine (CID 79775704) is N-[(5-ethoxy-2-pyridinyl)methyl]ethanamine.
What is the SMILES notation for N-[(5-ethoxy-2-pyridinyl)methyl]ethanamine?
The canonical SMILES for N-[(5-ethoxy-2-pyridinyl)methyl]ethanamine is CCNCc1ccc(OCC)cn1.
What is the InChIKey of N-[(5-ethoxy-2-pyridinyl)methyl]ethanamine?
The InChIKey is YIYNEOMITIHTEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O/c1-3-11-7-9-5-6-10(8-12-9)13-4-2/h5-6,8,11H,3-4,7H2,1-2H3.
What are the key properties of N-[(5-ethoxy-2-pyridinyl)methyl]ethanamine?
N-[(5-ethoxy-2-pyridinyl)methyl]ethanamine has a molecular weight of 180.25 g/mol, XLogP of 1.59, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-ethoxy-2-pyridinyl)methyl]ethanamine is sourced from PubChem (CID 79775704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).