4-(furan-2-yl)-2-phenyl-1H-pyrimidin-6-one

C14H10N2O2 — CID 136692919

IUPAC4-(furan-2-yl)-2-phenyl-1H-pyrimidin-6-one
SMILESO=c1cc(-c2ccco2)nc(-c2ccccc2)[nH]1
InChIInChI=1S/C14H10N2O2/c17-13-9-11(12-7-4-8-18-12)15-14(16-13)10-5-2-1-3-6-10/h1-9H,(H,15,16,17)
InChIKeyDMMXXQDLPDHTKJ-UHFFFAOYSA-N
MW238.25 g/mol
LogP2.70
Rot. Bonds2

About 4-(furan-2-yl)-2-phenyl-1H-pyrimidin-6-one

4-(furan-2-yl)-2-phenyl-1H-pyrimidin-6-one (PubChem CID 136692919) has the molecular formula C14H10N2O2 and a molecular weight of 238.25 g/mol. Its IUPAC name is 4-(furan-2-yl)-2-phenyl-1H-pyrimidin-6-one.

Molecular Properties

Compound Name4-(furan-2-yl)-2-phenyl-1H-pyrimidin-6-one
PubChem CID136692919
Molecular FormulaC14H10N2O2
Molecular Weight238.25 g/mol
Exact Mass238.07
IUPAC Name4-(furan-2-yl)-2-phenyl-1H-pyrimidin-6-one
SMILESO=c1cc(-c2ccco2)nc(-c2ccccc2)[nH]1
InChIInChI=1S/C14H10N2O2/c17-13-9-11(12-7-4-8-18-12)15-14(16-13)10-5-2-1-3-6-10/h1-9H,(H,15,16,17)
InChIKeyDMMXXQDLPDHTKJ-UHFFFAOYSA-N
XLogP2.70
TPSA58.89 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.25
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,4-diphenyl-1H-pyrimidin-6-one
CID 135475560
2-ethyl-4-(furan-2-yl)-1H-pyrimidin-6-one
CID 136692914
2-phenyl-4-(1H-pyrrol-2-yl)-1H-pyrimidin-6-one
CID 136955770
4-(2-fluorophenyl)-2-phenyl-1H-pyrimidin-6-one
CID 136692393
4-(3,4-dimethylphenyl)-2-phenyl-1H-pyrimidin-6-one
CID 136692457
2-naphthalen-2-yl-4-phenyl-1H-pyrimidin-6-one
CID 135932128
4-(5-fluoro-3-pyridinyl)-2-phenyl-1H-pyrimidin-6-one
CID 136692272
N-[3-(furan-2-yl)-1-(6-oxo-4-phenyl-1H-pyrimidin-2-yl)pyrazol-5-yl]acetamide
CID 136615189
4-(4-chloro-2-fluorophenyl)-2-phenyl-1H-pyrimidin-6-one
CID 136769719
6-(furan-2-yl)-2-phenyl-1H-imidazo[4,5-b]pyridine
CID 23025770
4-(2-chloro-4-fluorophenyl)-2-phenyl-1H-pyrimidin-6-one
CID 136769977
4-(furan-2-yl)-6-(4-phenylphenyl)pyrimidin-2-amine
CID 75360077

Frequently Asked Questions

What is the IUPAC name of 4-(furan-2-yl)-2-phenyl-1H-pyrimidin-6-one?
The IUPAC name of 4-(furan-2-yl)-2-phenyl-1H-pyrimidin-6-one (CID 136692919) is 4-(furan-2-yl)-2-phenyl-1H-pyrimidin-6-one.
What is the SMILES notation for 4-(furan-2-yl)-2-phenyl-1H-pyrimidin-6-one?
The canonical SMILES for 4-(furan-2-yl)-2-phenyl-1H-pyrimidin-6-one is O=c1cc(-c2ccco2)nc(-c2ccccc2)[nH]1.
What is the InChIKey of 4-(furan-2-yl)-2-phenyl-1H-pyrimidin-6-one?
The InChIKey is DMMXXQDLPDHTKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10N2O2/c17-13-9-11(12-7-4-8-18-12)15-14(16-13)10-5-2-1-3-6-10/h1-9H,(H,15,16,17).
What are the key properties of 4-(furan-2-yl)-2-phenyl-1H-pyrimidin-6-one?
4-(furan-2-yl)-2-phenyl-1H-pyrimidin-6-one has a molecular weight of 238.25 g/mol, XLogP of 2.70, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(furan-2-yl)-2-phenyl-1H-pyrimidin-6-one is sourced from PubChem (CID 136692919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).