6-[2-(dimethylamino)ethenyl]-5-(furan-2-carbonyl)-1H-pyridin-2-one

C14H14N2O3 — CID 54332284

IUPAC6-[2-(dimethylamino)ethenyl]-5-(furan-2-carbonyl)-1H-pyridin-2-one
SMILESCN(C)C=Cc1[nH]c(=O)ccc1C(=O)c1ccco1
InChIInChI=1S/C14H14N2O3/c1-16(2)8-7-11-10(5-6-13(17)15-11)14(18)12-4-3-9-19-12/h3-9H,1-2H3,(H,15,17)
InChIKeySZEGOMBSPWIQQI-UHFFFAOYSA-N
MW258.28 g/mol
LogP1.73
Rot. Bonds4

About 6-[2-(dimethylamino)ethenyl]-5-(furan-2-carbonyl)-1H-pyridin-2-one

6-[2-(dimethylamino)ethenyl]-5-(furan-2-carbonyl)-1H-pyridin-2-one (PubChem CID 54332284) has the molecular formula C14H14N2O3 and a molecular weight of 258.28 g/mol. Its IUPAC name is 6-[2-(dimethylamino)ethenyl]-5-(furan-2-carbonyl)-1H-pyridin-2-one.

Molecular Properties

Compound Name6-[2-(dimethylamino)ethenyl]-5-(furan-2-carbonyl)-1H-pyridin-2-one
PubChem CID54332284
Molecular FormulaC14H14N2O3
Molecular Weight258.28 g/mol
Exact Mass258.10
IUPAC Name6-[2-(dimethylamino)ethenyl]-5-(furan-2-carbonyl)-1H-pyridin-2-one
SMILESCN(C)C=Cc1[nH]c(=O)ccc1C(=O)c1ccco1
InChIInChI=1S/C14H14N2O3/c1-16(2)8-7-11-10(5-6-13(17)15-11)14(18)12-4-3-9-19-12/h3-9H,1-2H3,(H,15,17)
InChIKeySZEGOMBSPWIQQI-UHFFFAOYSA-N
XLogP1.73
TPSA66.31 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.28
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-[2-(dimethylamino)ethenyl]-5-(furan-2-carbonyl)-1H-pyridin-2-one?
The IUPAC name of 6-[2-(dimethylamino)ethenyl]-5-(furan-2-carbonyl)-1H-pyridin-2-one (CID 54332284) is 6-[2-(dimethylamino)ethenyl]-5-(furan-2-carbonyl)-1H-pyridin-2-one.
What is the SMILES notation for 6-[2-(dimethylamino)ethenyl]-5-(furan-2-carbonyl)-1H-pyridin-2-one?
The canonical SMILES for 6-[2-(dimethylamino)ethenyl]-5-(furan-2-carbonyl)-1H-pyridin-2-one is CN(C)C=Cc1[nH]c(=O)ccc1C(=O)c1ccco1.
What is the InChIKey of 6-[2-(dimethylamino)ethenyl]-5-(furan-2-carbonyl)-1H-pyridin-2-one?
The InChIKey is SZEGOMBSPWIQQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O3/c1-16(2)8-7-11-10(5-6-13(17)15-11)14(18)12-4-3-9-19-12/h3-9H,1-2H3,(H,15,17).
What are the key properties of 6-[2-(dimethylamino)ethenyl]-5-(furan-2-carbonyl)-1H-pyridin-2-one?
6-[2-(dimethylamino)ethenyl]-5-(furan-2-carbonyl)-1H-pyridin-2-one has a molecular weight of 258.28 g/mol, XLogP of 1.73, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-(dimethylamino)ethenyl]-5-(furan-2-carbonyl)-1H-pyridin-2-one is sourced from PubChem (CID 54332284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).