1-(1-ethenyl-3-methyl-6-methylidene-2-pyridinyl)-N-(2-methoxyethyl)-N-methylethanamine

C15H24N2O — CID 142300677

IUPAC1-(1-ethenyl-3-methyl-6-methylidene-2-pyridinyl)-N-(2-methoxyethyl)-N-methylethanamine
SMILESC=CN1C(=C)C=CC(C)=C1C(C)N(C)CCOC
InChIInChI=1S/C15H24N2O/c1-7-17-13(3)9-8-12(2)15(17)14(4)16(5)10-11-18-6/h7-9,14H,1,3,10-11H2,2,4-6H3
InChIKeyZOSLUSGUWVCGGZ-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.76
Rot. Bonds6

About 1-(1-ethenyl-3-methyl-6-methylidene-2-pyridinyl)-N-(2-methoxyethyl)-N-methylethanamine

1-(1-ethenyl-3-methyl-6-methylidene-2-pyridinyl)-N-(2-methoxyethyl)-N-methylethanamine (PubChem CID 142300677) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is 1-(1-ethenyl-3-methyl-6-methylidene-2-pyridinyl)-N-(2-methoxyethyl)-N-methylethanamine.

Molecular Properties

Compound Name1-(1-ethenyl-3-methyl-6-methylidene-2-pyridinyl)-N-(2-methoxyethyl)-N-methylethanamine
PubChem CID142300677
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name1-(1-ethenyl-3-methyl-6-methylidene-2-pyridinyl)-N-(2-methoxyethyl)-N-methylethanamine
SMILESC=CN1C(=C)C=CC(C)=C1C(C)N(C)CCOC
InChIInChI=1S/C15H24N2O/c1-7-17-13(3)9-8-12(2)15(17)14(4)16(5)10-11-18-6/h7-9,14H,1,3,10-11H2,2,4-6H3
InChIKeyZOSLUSGUWVCGGZ-UHFFFAOYSA-N
XLogP2.76
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(1-ethenyl-3-methyl-6-methylidene-2-pyridinyl)-N-(2-methoxyethyl)-N-methylethanamine?
The IUPAC name of 1-(1-ethenyl-3-methyl-6-methylidene-2-pyridinyl)-N-(2-methoxyethyl)-N-methylethanamine (CID 142300677) is 1-(1-ethenyl-3-methyl-6-methylidene-2-pyridinyl)-N-(2-methoxyethyl)-N-methylethanamine.
What is the SMILES notation for 1-(1-ethenyl-3-methyl-6-methylidene-2-pyridinyl)-N-(2-methoxyethyl)-N-methylethanamine?
The canonical SMILES for 1-(1-ethenyl-3-methyl-6-methylidene-2-pyridinyl)-N-(2-methoxyethyl)-N-methylethanamine is C=CN1C(=C)C=CC(C)=C1C(C)N(C)CCOC.
What is the InChIKey of 1-(1-ethenyl-3-methyl-6-methylidene-2-pyridinyl)-N-(2-methoxyethyl)-N-methylethanamine?
The InChIKey is ZOSLUSGUWVCGGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-7-17-13(3)9-8-12(2)15(17)14(4)16(5)10-11-18-6/h7-9,14H,1,3,10-11H2,2,4-6H3.
What are the key properties of 1-(1-ethenyl-3-methyl-6-methylidene-2-pyridinyl)-N-(2-methoxyethyl)-N-methylethanamine?
1-(1-ethenyl-3-methyl-6-methylidene-2-pyridinyl)-N-(2-methoxyethyl)-N-methylethanamine has a molecular weight of 248.37 g/mol, XLogP of 2.76, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-ethenyl-3-methyl-6-methylidene-2-pyridinyl)-N-(2-methoxyethyl)-N-methylethanamine is sourced from PubChem (CID 142300677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).