5-methoxy-N-[2-(2-methylprop-2-enoxy)ethyl]pyridin-2-amine

C12H18N2O2 — CID 106504298

IUPAC5-methoxy-N-[2-(2-methylprop-2-enoxy)ethyl]pyridin-2-amine
SMILESC=C(C)COCCNc1ccc(OC)cn1
InChIInChI=1S/C12H18N2O2/c1-10(2)9-16-7-6-13-12-5-4-11(15-3)8-14-12/h4-5,8H,1,6-7,9H2,2-3H3,(H,13,14)
InChIKeyVUQIDCDZQRSNKH-UHFFFAOYSA-N
MW222.29 g/mol
LogP2.09
Rot. Bonds7

About 5-methoxy-N-[2-(2-methylprop-2-enoxy)ethyl]pyridin-2-amine

5-methoxy-N-[2-(2-methylprop-2-enoxy)ethyl]pyridin-2-amine (PubChem CID 106504298) has the molecular formula C12H18N2O2 and a molecular weight of 222.29 g/mol. Its IUPAC name is 5-methoxy-N-[2-(2-methylprop-2-enoxy)ethyl]pyridin-2-amine.

Molecular Properties

Compound Name5-methoxy-N-[2-(2-methylprop-2-enoxy)ethyl]pyridin-2-amine
PubChem CID106504298
Molecular FormulaC12H18N2O2
Molecular Weight222.29 g/mol
Exact Mass222.14
IUPAC Name5-methoxy-N-[2-(2-methylprop-2-enoxy)ethyl]pyridin-2-amine
SMILESC=C(C)COCCNc1ccc(OC)cn1
InChIInChI=1S/C12H18N2O2/c1-10(2)9-16-7-6-13-12-5-4-11(15-3)8-14-12/h4-5,8H,1,6-7,9H2,2-3H3,(H,13,14)
InChIKeyVUQIDCDZQRSNKH-UHFFFAOYSA-N
XLogP2.09
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

6-[2-(2-methylprop-2-enoxy)ethylamino]pyridine-3-carboxylic acid
CID 114468121
5-methoxy-N-propylpyridin-2-amine
CID 106503925
6-methoxy-N-[2-(2-methylprop-2-enoxy)ethyl]isoquinolin-1-amine
CID 106539948
5-methoxy-N-(2-methylsulfanylethyl)pyridin-2-amine
CID 106504113
5-methoxy-N-(3-phenoxypropyl)pyridin-2-amine
CID 106504081
5-bromo-N-[2-[(4-methoxyphenyl)methoxy]ethyl]pyridin-2-amine
CID 133444684
N-(6-chlorohexyl)-5-methoxypyridin-2-amine
CID 107846199
N'-(5-methoxy-2-pyridinyl)pentane-1,5-diamine
CID 107323439
1-N-(5-methoxy-2-pyridinyl)butane-1,3-diamine
CID 106504408
N-(3-chlorobutyl)-5-methoxypyridin-2-amine
CID 106505086
6-fluoro-N-[2-(2-methylprop-2-enoxy)ethyl]pyridin-2-amine
CID 103768547
5-bromo-4-methoxy-N-[2-(2-methylprop-2-enoxy)ethyl]pyrimidin-2-amine
CID 103768548

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-N-[2-(2-methylprop-2-enoxy)ethyl]pyridin-2-amine?
The IUPAC name of 5-methoxy-N-[2-(2-methylprop-2-enoxy)ethyl]pyridin-2-amine (CID 106504298) is 5-methoxy-N-[2-(2-methylprop-2-enoxy)ethyl]pyridin-2-amine.
What is the SMILES notation for 5-methoxy-N-[2-(2-methylprop-2-enoxy)ethyl]pyridin-2-amine?
The canonical SMILES for 5-methoxy-N-[2-(2-methylprop-2-enoxy)ethyl]pyridin-2-amine is C=C(C)COCCNc1ccc(OC)cn1.
What is the InChIKey of 5-methoxy-N-[2-(2-methylprop-2-enoxy)ethyl]pyridin-2-amine?
The InChIKey is VUQIDCDZQRSNKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O2/c1-10(2)9-16-7-6-13-12-5-4-11(15-3)8-14-12/h4-5,8H,1,6-7,9H2,2-3H3,(H,13,14).
What are the key properties of 5-methoxy-N-[2-(2-methylprop-2-enoxy)ethyl]pyridin-2-amine?
5-methoxy-N-[2-(2-methylprop-2-enoxy)ethyl]pyridin-2-amine has a molecular weight of 222.29 g/mol, XLogP of 2.09, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-N-[2-(2-methylprop-2-enoxy)ethyl]pyridin-2-amine is sourced from PubChem (CID 106504298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).