furan;1,2,3,4-tetrahydropyrimidine

C8H12N2O — CID 162239059

IUPACfuran;1,2,3,4-tetrahydropyrimidine
SMILESC1=CNCNC1.c1ccoc1
InChIInChI=1S/C4H8N2.C4H4O/c1-2-5-4-6-3-1;1-2-4-5-3-1/h1-2,5-6H,3-4H2;1-4H
InChIKeyZWLMZHMGAIFTDF-UHFFFAOYSA-N
MW152.20 g/mol
LogP0.93
Rot. Bonds

About furan;1,2,3,4-tetrahydropyrimidine

furan;1,2,3,4-tetrahydropyrimidine (PubChem CID 162239059) has the molecular formula C8H12N2O and a molecular weight of 152.20 g/mol. Its IUPAC name is furan;1,2,3,4-tetrahydropyrimidine.

Molecular Properties

Compound Namefuran;1,2,3,4-tetrahydropyrimidine
PubChem CID162239059
Molecular FormulaC8H12N2O
Molecular Weight152.20 g/mol
Exact Mass152.09
IUPAC Namefuran;1,2,3,4-tetrahydropyrimidine
SMILESC1=CNCNC1.c1ccoc1
InChIInChI=1S/C4H8N2.C4H4O/c1-2-5-4-6-3-1;1-2-4-5-3-1/h1-2,5-6H,3-4H2;1-4H
InChIKeyZWLMZHMGAIFTDF-UHFFFAOYSA-N
XLogP0.93
TPSA37.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.20
LogP ≤ 50.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of furan;1,2,3,4-tetrahydropyrimidine?
The IUPAC name of furan;1,2,3,4-tetrahydropyrimidine (CID 162239059) is furan;1,2,3,4-tetrahydropyrimidine.
What is the SMILES notation for furan;1,2,3,4-tetrahydropyrimidine?
The canonical SMILES for furan;1,2,3,4-tetrahydropyrimidine is C1=CNCNC1.c1ccoc1.
What is the InChIKey of furan;1,2,3,4-tetrahydropyrimidine?
The InChIKey is ZWLMZHMGAIFTDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8N2.C4H4O/c1-2-5-4-6-3-1;1-2-4-5-3-1/h1-2,5-6H,3-4H2;1-4H.
What are the key properties of furan;1,2,3,4-tetrahydropyrimidine?
furan;1,2,3,4-tetrahydropyrimidine has a molecular weight of 152.20 g/mol, XLogP of 0.93, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for furan;1,2,3,4-tetrahydropyrimidine is sourced from PubChem (CID 162239059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).