(5E)-5-ethylidene-1-(4-ethylphenyl)-6-methylidene-4-oxopyridine-3-carboxamide

C17H18N2O2 — CID 143666447

IUPAC(5E)-5-ethylidene-1-(4-ethylphenyl)-6-methylidene-4-oxopyridine-3-carboxamide
SMILESC=c1/c(=C\C)c(=O)c(C(N)=O)cn1-c1ccc(CC)cc1
InChIInChI=1S/C17H18N2O2/c1-4-12-6-8-13(9-7-12)19-10-15(17(18)21)16(20)14(5-2)11(19)3/h5-10H,3-4H2,1-2H3,(H2,18,21)/b14-5+
InChIKeyRNLPGAPANPJTMJ-LHHJGKSTSA-N
MW282.34 g/mol
LogP0.71
Rot. Bonds3

About (5E)-5-ethylidene-1-(4-ethylphenyl)-6-methylidene-4-oxopyridine-3-carboxamide

(5E)-5-ethylidene-1-(4-ethylphenyl)-6-methylidene-4-oxopyridine-3-carboxamide (PubChem CID 143666447) has the molecular formula C17H18N2O2 and a molecular weight of 282.34 g/mol. Its IUPAC name is (5E)-5-ethylidene-1-(4-ethylphenyl)-6-methylidene-4-oxopyridine-3-carboxamide.

Molecular Properties

Compound Name(5E)-5-ethylidene-1-(4-ethylphenyl)-6-methylidene-4-oxopyridine-3-carboxamide
PubChem CID143666447
Molecular FormulaC17H18N2O2
Molecular Weight282.34 g/mol
Exact Mass282.14
IUPAC Name(5E)-5-ethylidene-1-(4-ethylphenyl)-6-methylidene-4-oxopyridine-3-carboxamide
SMILESC=c1/c(=C\C)c(=O)c(C(N)=O)cn1-c1ccc(CC)cc1
InChIInChI=1S/C17H18N2O2/c1-4-12-6-8-13(9-7-12)19-10-15(17(18)21)16(20)14(5-2)11(19)3/h5-10H,3-4H2,1-2H3,(H2,18,21)/b14-5+
InChIKeyRNLPGAPANPJTMJ-LHHJGKSTSA-N
XLogP0.71
TPSA65.09 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.34
LogP ≤ 50.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (5E)-5-ethylidene-1-(4-ethylphenyl)-6-methylidene-4-oxopyridine-3-carboxamide?
The IUPAC name of (5E)-5-ethylidene-1-(4-ethylphenyl)-6-methylidene-4-oxopyridine-3-carboxamide (CID 143666447) is (5E)-5-ethylidene-1-(4-ethylphenyl)-6-methylidene-4-oxopyridine-3-carboxamide.
What is the SMILES notation for (5E)-5-ethylidene-1-(4-ethylphenyl)-6-methylidene-4-oxopyridine-3-carboxamide?
The canonical SMILES for (5E)-5-ethylidene-1-(4-ethylphenyl)-6-methylidene-4-oxopyridine-3-carboxamide is C=c1/c(=C\C)c(=O)c(C(N)=O)cn1-c1ccc(CC)cc1.
What is the InChIKey of (5E)-5-ethylidene-1-(4-ethylphenyl)-6-methylidene-4-oxopyridine-3-carboxamide?
The InChIKey is RNLPGAPANPJTMJ-LHHJGKSTSA-N. The full InChI is InChI=1S/C17H18N2O2/c1-4-12-6-8-13(9-7-12)19-10-15(17(18)21)16(20)14(5-2)11(19)3/h5-10H,3-4H2,1-2H3,(H2,18,21)/b14-5+.
What are the key properties of (5E)-5-ethylidene-1-(4-ethylphenyl)-6-methylidene-4-oxopyridine-3-carboxamide?
(5E)-5-ethylidene-1-(4-ethylphenyl)-6-methylidene-4-oxopyridine-3-carboxamide has a molecular weight of 282.34 g/mol, XLogP of 0.71, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5E)-5-ethylidene-1-(4-ethylphenyl)-6-methylidene-4-oxopyridine-3-carboxamide is sourced from PubChem (CID 143666447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).