6-(2-propan-2-yloxyethoxy)-N-propylpyridin-2-amine

C13H22N2O2 — CID 80860049

IUPAC6-(2-propan-2-yloxyethoxy)-N-propylpyridin-2-amine
SMILESCCCNc1cccc(OCCOC(C)C)n1
InChIInChI=1S/C13H22N2O2/c1-4-8-14-12-6-5-7-13(15-12)17-10-9-16-11(2)3/h5-7,11H,4,8-10H2,1-3H3,(H,14,15)
InChIKeyXGDUWFWMAOVZJF-UHFFFAOYSA-N
MW238.33 g/mol
LogP2.71
Rot. Bonds8

About 6-(2-propan-2-yloxyethoxy)-N-propylpyridin-2-amine

6-(2-propan-2-yloxyethoxy)-N-propylpyridin-2-amine (PubChem CID 80860049) has the molecular formula C13H22N2O2 and a molecular weight of 238.33 g/mol. Its IUPAC name is 6-(2-propan-2-yloxyethoxy)-N-propylpyridin-2-amine.

Molecular Properties

Compound Name6-(2-propan-2-yloxyethoxy)-N-propylpyridin-2-amine
PubChem CID80860049
Molecular FormulaC13H22N2O2
Molecular Weight238.33 g/mol
Exact Mass238.17
IUPAC Name6-(2-propan-2-yloxyethoxy)-N-propylpyridin-2-amine
SMILESCCCNc1cccc(OCCOC(C)C)n1
InChIInChI=1S/C13H22N2O2/c1-4-8-14-12-6-5-7-13(15-12)17-10-9-16-11(2)3/h5-7,11H,4,8-10H2,1-3H3,(H,14,15)
InChIKeyXGDUWFWMAOVZJF-UHFFFAOYSA-N
XLogP2.71
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 52.71
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

N-ethyl-6-(2-propan-2-yloxyethoxy)pyridin-2-amine
CID 80860828
6-(3-methylbutoxy)-N-propylpyridin-2-amine
CID 80859395
N-methyl-6-(2-propan-2-yloxyethoxy)pyridin-2-amine
CID 80860052
6-methoxy-N-(2-propan-2-yloxyethyl)pyridin-2-amine
CID 104762395
6-(2-propan-2-yloxyethoxymethyl)-N-propylpyridin-2-amine
CID 79240041
6-[3-(dimethylamino)propoxy]-N-propylpyridin-2-amine
CID 80871017
N-propyl-6-prop-2-ynoxypyridin-2-amine
CID 80861470
6-prop-2-enoxy-N-propylpyridin-2-amine
CID 80868454
6-[(E)-but-2-enoxy]-N-propylpyridin-2-amine
CID 80872267
6-[(2-methylpropan-2-yl)oxy]-N-propylpyridin-2-amine
CID 80861017
2-fluoro-6-(2-propan-2-yloxyethoxy)pyridine
CID 61229543
6-butoxy-N-ethylpyridin-2-amine
CID 80867318

Frequently Asked Questions

What is the IUPAC name of 6-(2-propan-2-yloxyethoxy)-N-propylpyridin-2-amine?
The IUPAC name of 6-(2-propan-2-yloxyethoxy)-N-propylpyridin-2-amine (CID 80860049) is 6-(2-propan-2-yloxyethoxy)-N-propylpyridin-2-amine.
What is the SMILES notation for 6-(2-propan-2-yloxyethoxy)-N-propylpyridin-2-amine?
The canonical SMILES for 6-(2-propan-2-yloxyethoxy)-N-propylpyridin-2-amine is CCCNc1cccc(OCCOC(C)C)n1.
What is the InChIKey of 6-(2-propan-2-yloxyethoxy)-N-propylpyridin-2-amine?
The InChIKey is XGDUWFWMAOVZJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O2/c1-4-8-14-12-6-5-7-13(15-12)17-10-9-16-11(2)3/h5-7,11H,4,8-10H2,1-3H3,(H,14,15).
What are the key properties of 6-(2-propan-2-yloxyethoxy)-N-propylpyridin-2-amine?
6-(2-propan-2-yloxyethoxy)-N-propylpyridin-2-amine has a molecular weight of 238.33 g/mol, XLogP of 2.71, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-propan-2-yloxyethoxy)-N-propylpyridin-2-amine is sourced from PubChem (CID 80860049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).