5-(2-ethylhexoxymethyl)-N-propylpyridin-2-amine

C17H30N2O — CID 63486716

IUPAC5-(2-ethylhexoxymethyl)-N-propylpyridin-2-amine
SMILESCCCCC(CC)COCc1ccc(NCCC)nc1
InChIInChI=1S/C17H30N2O/c1-4-7-8-15(6-3)13-20-14-16-9-10-17(19-12-16)18-11-5-2/h9-10,12,15H,4-8,11,13-14H2,1-3H3,(H,18,19)
InChIKeyJTDLLKKNHZFHSP-UHFFFAOYSA-N
MW278.44 g/mol
LogP4.64
Rot. Bonds11

About 5-(2-ethylhexoxymethyl)-N-propylpyridin-2-amine

5-(2-ethylhexoxymethyl)-N-propylpyridin-2-amine (PubChem CID 63486716) has the molecular formula C17H30N2O and a molecular weight of 278.44 g/mol. Its IUPAC name is 5-(2-ethylhexoxymethyl)-N-propylpyridin-2-amine.

Molecular Properties

Compound Name5-(2-ethylhexoxymethyl)-N-propylpyridin-2-amine
PubChem CID63486716
Molecular FormulaC17H30N2O
Molecular Weight278.44 g/mol
Exact Mass278.24
IUPAC Name5-(2-ethylhexoxymethyl)-N-propylpyridin-2-amine
SMILESCCCCC(CC)COCc1ccc(NCCC)nc1
InChIInChI=1S/C17H30N2O/c1-4-7-8-15(6-3)13-20-14-16-9-10-17(19-12-16)18-11-5-2/h9-10,12,15H,4-8,11,13-14H2,1-3H3,(H,18,19)
InChIKeyJTDLLKKNHZFHSP-UHFFFAOYSA-N
XLogP4.64
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds11
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.44
LogP ≤ 54.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-tert-butyl-4-(2-ethylhexoxymethyl)benzene
CID 134220783
5-(3-methoxypropoxymethyl)-N-propylpyridin-2-amine
CID 62193134
N-[[4-(2-ethylhexoxymethyl)phenyl]methyl]ethanamine
CID 63491260
[4-(2-ethylhexoxymethyl)-2-pyridinyl]hydrazine
CID 62464671
5-[(4-ethylphenoxy)methyl]-N-propylpyridin-2-amine
CID 62194753
N-propyl-5-(thiophen-2-ylmethoxymethyl)pyridin-2-amine
CID 55044939
5-[(4-methylphenoxy)methyl]-N-propylpyridin-2-amine
CID 62193904
5-(aminomethyl)-N-pentylpyridin-2-amine
CID 95437328
5-[(2,6-dibromophenoxy)methyl]-N-propylpyridin-2-amine
CID 63484948
5-(pentylsulfanylmethyl)-N-propylpyridin-2-amine
CID 107756485
5-(oxolan-2-ylmethoxymethyl)-N-propylpyridin-2-amine
CID 62194442
[5-(butoxymethyl)-2-pyridinyl]hydrazine
CID 62245667

Frequently Asked Questions

What is the IUPAC name of 5-(2-ethylhexoxymethyl)-N-propylpyridin-2-amine?
The IUPAC name of 5-(2-ethylhexoxymethyl)-N-propylpyridin-2-amine (CID 63486716) is 5-(2-ethylhexoxymethyl)-N-propylpyridin-2-amine.
What is the SMILES notation for 5-(2-ethylhexoxymethyl)-N-propylpyridin-2-amine?
The canonical SMILES for 5-(2-ethylhexoxymethyl)-N-propylpyridin-2-amine is CCCCC(CC)COCc1ccc(NCCC)nc1.
What is the InChIKey of 5-(2-ethylhexoxymethyl)-N-propylpyridin-2-amine?
The InChIKey is JTDLLKKNHZFHSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30N2O/c1-4-7-8-15(6-3)13-20-14-16-9-10-17(19-12-16)18-11-5-2/h9-10,12,15H,4-8,11,13-14H2,1-3H3,(H,18,19).
What are the key properties of 5-(2-ethylhexoxymethyl)-N-propylpyridin-2-amine?
5-(2-ethylhexoxymethyl)-N-propylpyridin-2-amine has a molecular weight of 278.44 g/mol, XLogP of 4.64, 11 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-ethylhexoxymethyl)-N-propylpyridin-2-amine is sourced from PubChem (CID 63486716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).