5-(furan-2-ylmethylamino)-1-methylpyridin-2-one

C11H12N2O2 — CID 60930782

IUPAC5-(furan-2-ylmethylamino)-1-methylpyridin-2-one
SMILESCn1cc(NCc2ccco2)ccc1=O
InChIInChI=1S/C11H12N2O2/c1-13-8-9(4-5-11(13)14)12-7-10-3-2-6-15-10/h2-6,8,12H,7H2,1H3
InChIKeyQLSJDOFSPGQIOG-UHFFFAOYSA-N
MW204.23 g/mol
LogP1.59
Rot. Bonds3

About 5-(furan-2-ylmethylamino)-1-methylpyridin-2-one

5-(furan-2-ylmethylamino)-1-methylpyridin-2-one (PubChem CID 60930782) has the molecular formula C11H12N2O2 and a molecular weight of 204.23 g/mol. Its IUPAC name is 5-(furan-2-ylmethylamino)-1-methylpyridin-2-one.

Molecular Properties

Compound Name5-(furan-2-ylmethylamino)-1-methylpyridin-2-one
PubChem CID60930782
Molecular FormulaC11H12N2O2
Molecular Weight204.23 g/mol
Exact Mass204.09
IUPAC Name5-(furan-2-ylmethylamino)-1-methylpyridin-2-one
SMILESCn1cc(NCc2ccco2)ccc1=O
InChIInChI=1S/C11H12N2O2/c1-13-8-9(4-5-11(13)14)12-7-10-3-2-6-15-10/h2-6,8,12H,7H2,1H3
InChIKeyQLSJDOFSPGQIOG-UHFFFAOYSA-N
XLogP1.59
TPSA47.17 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.23
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-[(5-ethylfuran-2-yl)methylamino]-1-methylpyridin-2-one
CID 62345999
N-(furan-2-ylmethyl)-4-methylsulfonylaniline
CID 3511468
5-[(5-chlorothiophen-2-yl)methylamino]-1-methylpyridin-2-one
CID 60930792
N-[4-(furan-2-ylmethylamino)phenyl]ethanesulfonamide
CID 54866288
5-[(4,5-dibromothiophen-2-yl)methylamino]-1-methylpyridin-2-one
CID 102834614
1-methyl-5-[(4-phenylthiophen-2-yl)methylamino]pyridin-2-one
CID 61017248
5-[(1,3-dimethylpyrazol-4-yl)methylamino]-1-methylpyridin-2-one
CID 83088804
2-[4-(furan-2-ylmethylamino)phenyl]-N-methylacetamide
CID 43713977
N-[4-(furan-2-ylmethylamino)phenyl]-2-methylbenzamide
CID 112981783
1-methyl-5-[(5-methyl-2-pyridinyl)methylamino]pyridin-2-one
CID 81313295
1-[4-(furan-2-ylmethylamino)phenyl]-3-phenylurea
CID 112981834
N-(furan-2-ylmethyl)-4-(triazol-2-yl)aniline
CID 43740320

Frequently Asked Questions

What is the IUPAC name of 5-(furan-2-ylmethylamino)-1-methylpyridin-2-one?
The IUPAC name of 5-(furan-2-ylmethylamino)-1-methylpyridin-2-one (CID 60930782) is 5-(furan-2-ylmethylamino)-1-methylpyridin-2-one.
What is the SMILES notation for 5-(furan-2-ylmethylamino)-1-methylpyridin-2-one?
The canonical SMILES for 5-(furan-2-ylmethylamino)-1-methylpyridin-2-one is Cn1cc(NCc2ccco2)ccc1=O.
What is the InChIKey of 5-(furan-2-ylmethylamino)-1-methylpyridin-2-one?
The InChIKey is QLSJDOFSPGQIOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O2/c1-13-8-9(4-5-11(13)14)12-7-10-3-2-6-15-10/h2-6,8,12H,7H2,1H3.
What are the key properties of 5-(furan-2-ylmethylamino)-1-methylpyridin-2-one?
5-(furan-2-ylmethylamino)-1-methylpyridin-2-one has a molecular weight of 204.23 g/mol, XLogP of 1.59, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(furan-2-ylmethylamino)-1-methylpyridin-2-one is sourced from PubChem (CID 60930782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).