4-[2-[(2-methylpropan-2-yl)oxy]ethoxymethyl]-N-propylpyridin-2-amine

C15H26N2O2 — CID 112589451

IUPAC4-[2-[(2-methylpropan-2-yl)oxy]ethoxymethyl]-N-propylpyridin-2-amine
SMILESCCCNc1cc(COCCOC(C)(C)C)ccn1
InChIInChI=1S/C15H26N2O2/c1-5-7-16-14-11-13(6-8-17-14)12-18-9-10-19-15(2,3)4/h6,8,11H,5,7,9-10,12H2,1-4H3,(H,16,17)
InChIKeyXFALEYYTAXYYOZ-UHFFFAOYSA-N
MW266.38 g/mol
LogP3.24
Rot. Bonds8

About 4-[2-[(2-methylpropan-2-yl)oxy]ethoxymethyl]-N-propylpyridin-2-amine

4-[2-[(2-methylpropan-2-yl)oxy]ethoxymethyl]-N-propylpyridin-2-amine (PubChem CID 112589451) has the molecular formula C15H26N2O2 and a molecular weight of 266.38 g/mol. Its IUPAC name is 4-[2-[(2-methylpropan-2-yl)oxy]ethoxymethyl]-N-propylpyridin-2-amine.

Molecular Properties

Compound Name4-[2-[(2-methylpropan-2-yl)oxy]ethoxymethyl]-N-propylpyridin-2-amine
PubChem CID112589451
Molecular FormulaC15H26N2O2
Molecular Weight266.38 g/mol
Exact Mass266.20
IUPAC Name4-[2-[(2-methylpropan-2-yl)oxy]ethoxymethyl]-N-propylpyridin-2-amine
SMILESCCCNc1cc(COCCOC(C)(C)C)ccn1
InChIInChI=1S/C15H26N2O2/c1-5-7-16-14-11-13(6-8-17-14)12-18-9-10-19-15(2,3)4/h6,8,11H,5,7,9-10,12H2,1-4H3,(H,16,17)
InChIKeyXFALEYYTAXYYOZ-UHFFFAOYSA-N
XLogP3.24
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.38
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

4-(2-methoxyethoxymethyl)-N-propylpyridin-2-amine
CID 62466363
4-(2-cyclobutylethoxymethyl)-N-propylpyridin-2-amine
CID 114157922
N-propyl-4-(2,2,2-trifluoroethoxymethyl)pyridin-2-amine
CID 62463881
4-(furan-2-ylmethoxymethyl)-N-propylpyridin-2-amine
CID 62464220
4-[2-[(2-methylpropan-2-yl)oxy]ethoxymethyl]pyridine-2-carbonitrile
CID 112587627
N-methyl-4-(propoxymethyl)pyridin-2-amine
CID 62466206
4-[(3,5-difluorophenoxy)methyl]-N-propylpyridin-2-amine
CID 62786008
4-(pentan-2-yloxymethyl)-N-propylpyridin-2-amine
CID 102985121
4-[(4-chlorophenoxy)methyl]-N-propylpyridin-2-amine
CID 62465810
[4-[(2-methylpropan-2-yl)oxymethyl]-2-pyridinyl]hydrazine
CID 62464313
4-(diethylaminomethyl)-N-propylpyridin-2-amine
CID 62472000
4-[(4-bromo-3-methylphenoxy)methyl]-N-propylpyridin-2-amine
CID 83140667

Frequently Asked Questions

What is the IUPAC name of 4-[2-[(2-methylpropan-2-yl)oxy]ethoxymethyl]-N-propylpyridin-2-amine?
The IUPAC name of 4-[2-[(2-methylpropan-2-yl)oxy]ethoxymethyl]-N-propylpyridin-2-amine (CID 112589451) is 4-[2-[(2-methylpropan-2-yl)oxy]ethoxymethyl]-N-propylpyridin-2-amine.
What is the SMILES notation for 4-[2-[(2-methylpropan-2-yl)oxy]ethoxymethyl]-N-propylpyridin-2-amine?
The canonical SMILES for 4-[2-[(2-methylpropan-2-yl)oxy]ethoxymethyl]-N-propylpyridin-2-amine is CCCNc1cc(COCCOC(C)(C)C)ccn1.
What is the InChIKey of 4-[2-[(2-methylpropan-2-yl)oxy]ethoxymethyl]-N-propylpyridin-2-amine?
The InChIKey is XFALEYYTAXYYOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O2/c1-5-7-16-14-11-13(6-8-17-14)12-18-9-10-19-15(2,3)4/h6,8,11H,5,7,9-10,12H2,1-4H3,(H,16,17).
What are the key properties of 4-[2-[(2-methylpropan-2-yl)oxy]ethoxymethyl]-N-propylpyridin-2-amine?
4-[2-[(2-methylpropan-2-yl)oxy]ethoxymethyl]-N-propylpyridin-2-amine has a molecular weight of 266.38 g/mol, XLogP of 3.24, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[(2-methylpropan-2-yl)oxy]ethoxymethyl]-N-propylpyridin-2-amine is sourced from PubChem (CID 112589451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).