1,2-dihydropyrimidine;1,2,3,4-tetrahydropyrazine

C8H14N4 — CID 146216555

IUPAC1,2-dihydropyrimidine;1,2,3,4-tetrahydropyrazine
SMILESC1=CNCCN1.C1=CNCN=C1
InChIInChI=1S/C4H8N2.C4H6N2/c1-2-6-4-3-5-1;1-2-5-4-6-3-1/h1-2,5-6H,3-4H2;1-3,5H,4H2
InChIKeyBQYFBKGGVJGSLP-UHFFFAOYSA-N
MW166.23 g/mol
LogP-0.22
Rot. Bonds

About 1,2-dihydropyrimidine;1,2,3,4-tetrahydropyrazine

1,2-dihydropyrimidine;1,2,3,4-tetrahydropyrazine (PubChem CID 146216555) has the molecular formula C8H14N4 and a molecular weight of 166.23 g/mol. Its IUPAC name is 1,2-dihydropyrimidine;1,2,3,4-tetrahydropyrazine.

Molecular Properties

Compound Name1,2-dihydropyrimidine;1,2,3,4-tetrahydropyrazine
PubChem CID146216555
Molecular FormulaC8H14N4
Molecular Weight166.23 g/mol
Exact Mass166.12
IUPAC Name1,2-dihydropyrimidine;1,2,3,4-tetrahydropyrazine
SMILESC1=CNCCN1.C1=CNCN=C1
InChIInChI=1S/C4H8N2.C4H6N2/c1-2-6-4-3-5-1;1-2-5-4-6-3-1/h1-2,5-6H,3-4H2;1-3,5H,4H2
InChIKeyBQYFBKGGVJGSLP-UHFFFAOYSA-N
XLogP-0.22
TPSA48.45 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.23
LogP ≤ 5-0.22
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1,2-dihydropyrimidine;1,2,3,4-tetrahydropyrazine?
The IUPAC name of 1,2-dihydropyrimidine;1,2,3,4-tetrahydropyrazine (CID 146216555) is 1,2-dihydropyrimidine;1,2,3,4-tetrahydropyrazine.
What is the SMILES notation for 1,2-dihydropyrimidine;1,2,3,4-tetrahydropyrazine?
The canonical SMILES for 1,2-dihydropyrimidine;1,2,3,4-tetrahydropyrazine is C1=CNCCN1.C1=CNCN=C1.
What is the InChIKey of 1,2-dihydropyrimidine;1,2,3,4-tetrahydropyrazine?
The InChIKey is BQYFBKGGVJGSLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8N2.C4H6N2/c1-2-6-4-3-5-1;1-2-5-4-6-3-1/h1-2,5-6H,3-4H2;1-3,5H,4H2.
What are the key properties of 1,2-dihydropyrimidine;1,2,3,4-tetrahydropyrazine?
1,2-dihydropyrimidine;1,2,3,4-tetrahydropyrazine has a molecular weight of 166.23 g/mol, XLogP of -0.22, 0 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-dihydropyrimidine;1,2,3,4-tetrahydropyrazine is sourced from PubChem (CID 146216555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).