5-[(5-ethylfuran-2-yl)methylamino]-1-methylpyridin-2-one

C13H16N2O2 — CID 62345999

IUPAC5-[(5-ethylfuran-2-yl)methylamino]-1-methylpyridin-2-one
SMILESCCc1ccc(CNc2ccc(=O)n(C)c2)o1
InChIInChI=1S/C13H16N2O2/c1-3-11-5-6-12(17-11)8-14-10-4-7-13(16)15(2)9-10/h4-7,9,14H,3,8H2,1-2H3
InChIKeyCMFQKFSZHVFJFP-UHFFFAOYSA-N
MW232.28 g/mol
LogP2.15
Rot. Bonds4

About 5-[(5-ethylfuran-2-yl)methylamino]-1-methylpyridin-2-one

5-[(5-ethylfuran-2-yl)methylamino]-1-methylpyridin-2-one (PubChem CID 62345999) has the molecular formula C13H16N2O2 and a molecular weight of 232.28 g/mol. Its IUPAC name is 5-[(5-ethylfuran-2-yl)methylamino]-1-methylpyridin-2-one.

Molecular Properties

Compound Name5-[(5-ethylfuran-2-yl)methylamino]-1-methylpyridin-2-one
PubChem CID62345999
Molecular FormulaC13H16N2O2
Molecular Weight232.28 g/mol
Exact Mass232.12
IUPAC Name5-[(5-ethylfuran-2-yl)methylamino]-1-methylpyridin-2-one
SMILESCCc1ccc(CNc2ccc(=O)n(C)c2)o1
InChIInChI=1S/C13H16N2O2/c1-3-11-5-6-12(17-11)8-14-10-4-7-13(16)15(2)9-10/h4-7,9,14H,3,8H2,1-2H3
InChIKeyCMFQKFSZHVFJFP-UHFFFAOYSA-N
XLogP2.15
TPSA47.17 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.28
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-[(5-ethylthiophen-2-yl)methylamino]-1-methylpyridin-2-one
CID 62345735
5-(furan-2-ylmethylamino)-1-methylpyridin-2-one
CID 60930782
5-[[5-(methylsulfanylmethyl)furan-2-yl]methylamino]-1-propylpyridin-2-one
CID 60942932
N-[(5-ethylfuran-2-yl)methyl]-1-methylpyrazol-4-amine
CID 62346496
1-methyl-5-[(2-methylpyrazol-3-yl)methylamino]pyridin-2-one
CID 60930659
5-[(5-chlorofuran-2-yl)methylamino]-1-ethylpyridin-2-one
CID 54863971
5-[(4-hydroxyphenyl)methylamino]-1-methylpyridin-2-one
CID 54866090
5-[(5-chlorothiophen-2-yl)methylamino]-1-methylpyridin-2-one
CID 60930792
N-[(5-ethylfuran-2-yl)methyl]-4-propan-2-ylaniline
CID 62345235
3-[4-[(5-ethylfuran-2-yl)methylamino]phenyl]-1H-imidazol-2-one
CID 62345288
5-[(4,5-dibromothiophen-2-yl)methylamino]-1-methylpyridin-2-one
CID 102834614
5-[[4-(diethylamino)phenyl]methylamino]-1-methylpyridin-2-one
CID 60931040

Frequently Asked Questions

What is the IUPAC name of 5-[(5-ethylfuran-2-yl)methylamino]-1-methylpyridin-2-one?
The IUPAC name of 5-[(5-ethylfuran-2-yl)methylamino]-1-methylpyridin-2-one (CID 62345999) is 5-[(5-ethylfuran-2-yl)methylamino]-1-methylpyridin-2-one.
What is the SMILES notation for 5-[(5-ethylfuran-2-yl)methylamino]-1-methylpyridin-2-one?
The canonical SMILES for 5-[(5-ethylfuran-2-yl)methylamino]-1-methylpyridin-2-one is CCc1ccc(CNc2ccc(=O)n(C)c2)o1.
What is the InChIKey of 5-[(5-ethylfuran-2-yl)methylamino]-1-methylpyridin-2-one?
The InChIKey is CMFQKFSZHVFJFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O2/c1-3-11-5-6-12(17-11)8-14-10-4-7-13(16)15(2)9-10/h4-7,9,14H,3,8H2,1-2H3.
What are the key properties of 5-[(5-ethylfuran-2-yl)methylamino]-1-methylpyridin-2-one?
5-[(5-ethylfuran-2-yl)methylamino]-1-methylpyridin-2-one has a molecular weight of 232.28 g/mol, XLogP of 2.15, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(5-ethylfuran-2-yl)methylamino]-1-methylpyridin-2-one is sourced from PubChem (CID 62345999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).