6-(5-ethyl-4-methyl-6-prop-2-enoxypyrimidin-2-yl)pyridin-3-amine

C15H18N4O — CID 25184912

IUPAC6-(5-ethyl-4-methyl-6-prop-2-enoxypyrimidin-2-yl)pyridin-3-amine
SMILESC=CCOc1nc(-c2ccc(N)cn2)nc(C)c1CC
InChIInChI=1S/C15H18N4O/c1-4-8-20-15-12(5-2)10(3)18-14(19-15)13-7-6-11(16)9-17-13/h4,6-7,9H,1,5,8,16H2,2-3H3
InChIKeyDNDWMGBJOGKNSP-UHFFFAOYSA-N
MW270.34 g/mol
LogP2.56
Rot. Bonds5

About 6-(5-ethyl-4-methyl-6-prop-2-enoxypyrimidin-2-yl)pyridin-3-amine

6-(5-ethyl-4-methyl-6-prop-2-enoxypyrimidin-2-yl)pyridin-3-amine (PubChem CID 25184912) has the molecular formula C15H18N4O and a molecular weight of 270.34 g/mol. Its IUPAC name is 6-(5-ethyl-4-methyl-6-prop-2-enoxypyrimidin-2-yl)pyridin-3-amine.

Molecular Properties

Compound Name6-(5-ethyl-4-methyl-6-prop-2-enoxypyrimidin-2-yl)pyridin-3-amine
PubChem CID25184912
Molecular FormulaC15H18N4O
Molecular Weight270.34 g/mol
Exact Mass270.15
IUPAC Name6-(5-ethyl-4-methyl-6-prop-2-enoxypyrimidin-2-yl)pyridin-3-amine
SMILESC=CCOc1nc(-c2ccc(N)cn2)nc(C)c1CC
InChIInChI=1S/C15H18N4O/c1-4-8-20-15-12(5-2)10(3)18-14(19-15)13-7-6-11(16)9-17-13/h4,6-7,9H,1,5,8,16H2,2-3H3
InChIKeyDNDWMGBJOGKNSP-UHFFFAOYSA-N
XLogP2.56
TPSA73.92 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.34
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 6-(5-ethyl-4-methyl-6-prop-2-enoxypyrimidin-2-yl)pyridin-3-amine?
The IUPAC name of 6-(5-ethyl-4-methyl-6-prop-2-enoxypyrimidin-2-yl)pyridin-3-amine (CID 25184912) is 6-(5-ethyl-4-methyl-6-prop-2-enoxypyrimidin-2-yl)pyridin-3-amine.
What is the SMILES notation for 6-(5-ethyl-4-methyl-6-prop-2-enoxypyrimidin-2-yl)pyridin-3-amine?
The canonical SMILES for 6-(5-ethyl-4-methyl-6-prop-2-enoxypyrimidin-2-yl)pyridin-3-amine is C=CCOc1nc(-c2ccc(N)cn2)nc(C)c1CC.
What is the InChIKey of 6-(5-ethyl-4-methyl-6-prop-2-enoxypyrimidin-2-yl)pyridin-3-amine?
The InChIKey is DNDWMGBJOGKNSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O/c1-4-8-20-15-12(5-2)10(3)18-14(19-15)13-7-6-11(16)9-17-13/h4,6-7,9H,1,5,8,16H2,2-3H3.
What are the key properties of 6-(5-ethyl-4-methyl-6-prop-2-enoxypyrimidin-2-yl)pyridin-3-amine?
6-(5-ethyl-4-methyl-6-prop-2-enoxypyrimidin-2-yl)pyridin-3-amine has a molecular weight of 270.34 g/mol, XLogP of 2.56, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(5-ethyl-4-methyl-6-prop-2-enoxypyrimidin-2-yl)pyridin-3-amine is sourced from PubChem (CID 25184912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).