6-(furan-2-yl)-3-[4-(4-hydroxyphenyl)-3,6-dihydro-2H-pyridine-1-carbonyl]-1H-pyridin-2-one

C21H18N2O4 — CID 71883426

IUPAC6-(furan-2-yl)-3-[4-(4-hydroxyphenyl)-3,6-dihydro-2H-pyridine-1-carbonyl]-1H-pyridin-2-one
SMILESO=C(c1ccc(-c2ccco2)[nH]c1=O)N1CC=C(c2ccc(O)cc2)CC1
InChIInChI=1S/C21H18N2O4/c24-16-5-3-14(4-6-16)15-9-11-23(12-10-15)21(26)17-7-8-18(22-20(17)25)19-2-1-13-27-19/h1-9,13,24H,10-12H2,(H,22,25)
InChIKeyAHFAFWZTRNRBEX-UHFFFAOYSA-N
MW362.39 g/mol
LogP3.27
Rot. Bonds3

About 6-(furan-2-yl)-3-[4-(4-hydroxyphenyl)-3,6-dihydro-2H-pyridine-1-carbonyl]-1H-pyridin-2-one

6-(furan-2-yl)-3-[4-(4-hydroxyphenyl)-3,6-dihydro-2H-pyridine-1-carbonyl]-1H-pyridin-2-one (PubChem CID 71883426) has the molecular formula C21H18N2O4 and a molecular weight of 362.39 g/mol. Its IUPAC name is 6-(furan-2-yl)-3-[4-(4-hydroxyphenyl)-3,6-dihydro-2H-pyridine-1-carbonyl]-1H-pyridin-2-one.

Molecular Properties

Compound Name6-(furan-2-yl)-3-[4-(4-hydroxyphenyl)-3,6-dihydro-2H-pyridine-1-carbonyl]-1H-pyridin-2-one
PubChem CID71883426
Molecular FormulaC21H18N2O4
Molecular Weight362.39 g/mol
Exact Mass362.13
IUPAC Name6-(furan-2-yl)-3-[4-(4-hydroxyphenyl)-3,6-dihydro-2H-pyridine-1-carbonyl]-1H-pyridin-2-one
SMILESO=C(c1ccc(-c2ccco2)[nH]c1=O)N1CC=C(c2ccc(O)cc2)CC1
InChIInChI=1S/C21H18N2O4/c24-16-5-3-14(4-6-16)15-9-11-23(12-10-15)21(26)17-7-8-18(22-20(17)25)19-2-1-13-27-19/h1-9,13,24H,10-12H2,(H,22,25)
InChIKeyAHFAFWZTRNRBEX-UHFFFAOYSA-N
XLogP3.27
TPSA86.54 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.39
LogP ≤ 53.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 6-(furan-2-yl)-3-[4-(4-hydroxyphenyl)-3,6-dihydro-2H-pyridine-1-carbonyl]-1H-pyridin-2-one with MolForge

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Related Compounds

3-[(3R)-3-aminopyrrolidine-1-carbonyl]-6-(furan-2-yl)-1H-pyridin-2-one
CID 119410087
[4-(4-hydroxyphenyl)-3,6-dihydro-2H-pyridin-1-yl]-(2-sulfanylidene-1H-pyridin-3-yl)methanone
CID 154759899
4-[6-(furan-2-yl)-2-oxo-1H-pyridine-3-carbonyl]-N-(3-methylphenyl)piperazine-1-carboxamide
CID 56510199
4-[4-(4-hydroxyphenyl)-3,6-dihydro-2H-pyridine-1-carbonyl]-2H-phthalazin-1-one
CID 71943929
3-[(9aS)-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine-2-carbonyl]-6-(furan-2-yl)-1H-pyridin-2-one
CID 95977450
[5-hydroxy-2-(trifluoromethyl)phenyl]-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)methanone
CID 99792639
(5-bromo-2-iodophenyl)-[4-(4-hydroxyphenyl)-3,6-dihydro-2H-pyridin-1-yl]methanone
CID 112802745
3-[(2R)-2-(2-fluorophenyl)morpholine-4-carbonyl]-6-(furan-2-yl)-1H-pyridin-2-one
CID 95174394
6-(furan-2-yl)-3-[3-(methylaminomethyl)piperidine-1-carbonyl]-1H-pyridin-2-one;hydrochloride
CID 119395633
3-[(4aS,8aS)-2,3,4a,5,6,7,8,8a-octahydrobenzo[b][1,4]oxazine-4-carbonyl]-6-(furan-2-yl)-1H-pyridin-2-one
CID 95977327
3-[(1S)-1-ethyl-3,4-dihydro-1H-isoquinoline-2-carbonyl]-6-(furan-2-yl)-1H-pyridin-2-one
CID 95967541
(5-chlorothiophen-2-yl)-[4-(4-hydroxyphenyl)-3,6-dihydro-2H-pyridin-1-yl]methanone
CID 167849084

Frequently Asked Questions

What is the IUPAC name of 6-(furan-2-yl)-3-[4-(4-hydroxyphenyl)-3,6-dihydro-2H-pyridine-1-carbonyl]-1H-pyridin-2-one?
The IUPAC name of 6-(furan-2-yl)-3-[4-(4-hydroxyphenyl)-3,6-dihydro-2H-pyridine-1-carbonyl]-1H-pyridin-2-one (CID 71883426) is 6-(furan-2-yl)-3-[4-(4-hydroxyphenyl)-3,6-dihydro-2H-pyridine-1-carbonyl]-1H-pyridin-2-one.
What is the SMILES notation for 6-(furan-2-yl)-3-[4-(4-hydroxyphenyl)-3,6-dihydro-2H-pyridine-1-carbonyl]-1H-pyridin-2-one?
The canonical SMILES for 6-(furan-2-yl)-3-[4-(4-hydroxyphenyl)-3,6-dihydro-2H-pyridine-1-carbonyl]-1H-pyridin-2-one is O=C(c1ccc(-c2ccco2)[nH]c1=O)N1CC=C(c2ccc(O)cc2)CC1.
What is the InChIKey of 6-(furan-2-yl)-3-[4-(4-hydroxyphenyl)-3,6-dihydro-2H-pyridine-1-carbonyl]-1H-pyridin-2-one?
The InChIKey is AHFAFWZTRNRBEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18N2O4/c24-16-5-3-14(4-6-16)15-9-11-23(12-10-15)21(26)17-7-8-18(22-20(17)25)19-2-1-13-27-19/h1-9,13,24H,10-12H2,(H,22,25).
What are the key properties of 6-(furan-2-yl)-3-[4-(4-hydroxyphenyl)-3,6-dihydro-2H-pyridine-1-carbonyl]-1H-pyridin-2-one?
6-(furan-2-yl)-3-[4-(4-hydroxyphenyl)-3,6-dihydro-2H-pyridine-1-carbonyl]-1H-pyridin-2-one has a molecular weight of 362.39 g/mol, XLogP of 3.27, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(furan-2-yl)-3-[4-(4-hydroxyphenyl)-3,6-dihydro-2H-pyridine-1-carbonyl]-1H-pyridin-2-one is sourced from PubChem (CID 71883426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).