6-prop-2-enoxy-N-propylpyridin-2-amine

C11H16N2O — CID 80868454

IUPAC6-prop-2-enoxy-N-propylpyridin-2-amine
SMILESC=CCOc1cccc(NCCC)n1
InChIInChI=1S/C11H16N2O/c1-3-8-12-10-6-5-7-11(13-10)14-9-4-2/h4-7H,2-3,8-9H2,1H3,(H,12,13)
InChIKeyXVMYOZOITFRXJZ-UHFFFAOYSA-N
MW192.26 g/mol
LogP2.47
Rot. Bonds6

About 6-prop-2-enoxy-N-propylpyridin-2-amine

6-prop-2-enoxy-N-propylpyridin-2-amine (PubChem CID 80868454) has the molecular formula C11H16N2O and a molecular weight of 192.26 g/mol. Its IUPAC name is 6-prop-2-enoxy-N-propylpyridin-2-amine.

Molecular Properties

Compound Name6-prop-2-enoxy-N-propylpyridin-2-amine
PubChem CID80868454
Molecular FormulaC11H16N2O
Molecular Weight192.26 g/mol
Exact Mass192.13
IUPAC Name6-prop-2-enoxy-N-propylpyridin-2-amine
SMILESC=CCOc1cccc(NCCC)n1
InChIInChI=1S/C11H16N2O/c1-3-8-12-10-6-5-7-11(13-10)14-9-4-2/h4-7H,2-3,8-9H2,1H3,(H,12,13)
InChIKeyXVMYOZOITFRXJZ-UHFFFAOYSA-N
XLogP2.47
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

6-[(E)-but-2-enoxy]-N-propylpyridin-2-amine
CID 80872267
N-propyl-6-prop-2-ynoxypyridin-2-amine
CID 80861470
(6-prop-2-enoxy-2-pyridinyl)hydrazine
CID 80913717
6-(3-methylbutoxy)-N-propylpyridin-2-amine
CID 80859395
6-[(2-methylpropan-2-yl)oxy]-N-propylpyridin-2-amine
CID 80861017
6-[3-(dimethylamino)propoxy]-N-propylpyridin-2-amine
CID 80871017
6-(2-propan-2-yloxyethoxy)-N-propylpyridin-2-amine
CID 80860049
2-phenyl-6-prop-2-enoxy-N-propylpyrimidin-4-amine
CID 115915808
N-(2-chloroethyl)-6-ethoxypyridin-2-amine
CID 65029665
6-butoxy-N-ethylpyridin-2-amine
CID 80867318
N-propyl-6-quinolin-8-yloxypyridin-2-amine
CID 80874687
6-(3-methylphenoxy)-N-propylpyridin-2-amine
CID 80869779

Frequently Asked Questions

What is the IUPAC name of 6-prop-2-enoxy-N-propylpyridin-2-amine?
The IUPAC name of 6-prop-2-enoxy-N-propylpyridin-2-amine (CID 80868454) is 6-prop-2-enoxy-N-propylpyridin-2-amine.
What is the SMILES notation for 6-prop-2-enoxy-N-propylpyridin-2-amine?
The canonical SMILES for 6-prop-2-enoxy-N-propylpyridin-2-amine is C=CCOc1cccc(NCCC)n1.
What is the InChIKey of 6-prop-2-enoxy-N-propylpyridin-2-amine?
The InChIKey is XVMYOZOITFRXJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O/c1-3-8-12-10-6-5-7-11(13-10)14-9-4-2/h4-7H,2-3,8-9H2,1H3,(H,12,13).
What are the key properties of 6-prop-2-enoxy-N-propylpyridin-2-amine?
6-prop-2-enoxy-N-propylpyridin-2-amine has a molecular weight of 192.26 g/mol, XLogP of 2.47, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-prop-2-enoxy-N-propylpyridin-2-amine is sourced from PubChem (CID 80868454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).