2-(furan-2-yl)-1,4-dihydropyrimidine

C8H8N2O — CID 129140568

IUPAC2-(furan-2-yl)-1,4-dihydropyrimidine
SMILESC1=CNC(c2ccco2)=NC1
InChIInChI=1S/C8H8N2O/c1-3-7(11-6-1)8-9-4-2-5-10-8/h1-4,6H,5H2,(H,9,10)
InChIKeyCIKCFROASAPUAJ-UHFFFAOYSA-N
MW148.16 g/mol
LogP1.14
Rot. Bonds1

About 2-(furan-2-yl)-1,4-dihydropyrimidine

2-(furan-2-yl)-1,4-dihydropyrimidine (PubChem CID 129140568) has the molecular formula C8H8N2O and a molecular weight of 148.16 g/mol. Its IUPAC name is 2-(furan-2-yl)-1,4-dihydropyrimidine.

Molecular Properties

Compound Name2-(furan-2-yl)-1,4-dihydropyrimidine
PubChem CID129140568
Molecular FormulaC8H8N2O
Molecular Weight148.16 g/mol
Exact Mass148.06
IUPAC Name2-(furan-2-yl)-1,4-dihydropyrimidine
SMILESC1=CNC(c2ccco2)=NC1
InChIInChI=1S/C8H8N2O/c1-3-7(11-6-1)8-9-4-2-5-10-8/h1-4,6H,5H2,(H,9,10)
InChIKeyCIKCFROASAPUAJ-UHFFFAOYSA-N
XLogP1.14
TPSA37.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.16
LogP ≤ 51.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

ethane;2-(furan-2-yl)furan
CID 161366084
3-(furan-2-yl)-5-methyl-2,5-dihydro-1,2,4-oxadiazole
CID 10820747
5-amino-2-(furan-2-yl)-1H-pyrimidine-4,6-dione
CID 82171064
(1R,6S)-2,5-bis(furan-2-yl)-3,4-diazabicyclo[4.1.0]hepta-2,4-diene
CID 101124838
2-phenylfuran;piperazine
CID 68614405
5-(furan-2-yl)-1,2,3,6-tetrahydropyridine;hydrochloride
CID 119031101
4-(furan-2-yl)-2,3-dihydro-1,2,5-thiadiazole 1,1-dioxide
CID 142711092
2-(furan-2-yl)-1,3,5-triazine
CID 54453407
2-(2,4,6-trichlorophenyl)furan
CID 91803022
3-(furan-2-yl)-1,2-oxazole
CID 11147745
2-cyclopenta-1,4-dien-1-ylfuran;zirconium;dihydrochloride
CID 175334849
5-(chloromethyl)-3-(furan-2-yl)-1H-1,2,4-triazole
CID 79600359

Frequently Asked Questions

What is the IUPAC name of 2-(furan-2-yl)-1,4-dihydropyrimidine?
The IUPAC name of 2-(furan-2-yl)-1,4-dihydropyrimidine (CID 129140568) is 2-(furan-2-yl)-1,4-dihydropyrimidine.
What is the SMILES notation for 2-(furan-2-yl)-1,4-dihydropyrimidine?
The canonical SMILES for 2-(furan-2-yl)-1,4-dihydropyrimidine is C1=CNC(c2ccco2)=NC1.
What is the InChIKey of 2-(furan-2-yl)-1,4-dihydropyrimidine?
The InChIKey is CIKCFROASAPUAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N2O/c1-3-7(11-6-1)8-9-4-2-5-10-8/h1-4,6H,5H2,(H,9,10).
What are the key properties of 2-(furan-2-yl)-1,4-dihydropyrimidine?
2-(furan-2-yl)-1,4-dihydropyrimidine has a molecular weight of 148.16 g/mol, XLogP of 1.14, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-2-yl)-1,4-dihydropyrimidine is sourced from PubChem (CID 129140568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).