1,5-dihydropyrimido[5,4-d]pyrimidine

C6H6N4 — CID 142421412

IUPAC1,5-dihydropyrimido[5,4-d]pyrimidine
SMILESC1=NC=C2NC=NC=C2N1
InChIInChI=1S/C6H6N4/c1-5-6(10-3-7-1)2-8-4-9-5/h1-4H,(H,7,10)(H,8,9)
InChIKeyDJBRGSRRHLPVTQ-UHFFFAOYSA-N
MW134.14 g/mol
LogP-0.07
Rot. Bonds

About 1,5-dihydropyrimido[5,4-d]pyrimidine

1,5-dihydropyrimido[5,4-d]pyrimidine (PubChem CID 142421412) has the molecular formula C6H6N4 and a molecular weight of 134.14 g/mol. Its IUPAC name is 1,5-dihydropyrimido[5,4-d]pyrimidine.

Molecular Properties

Compound Name1,5-dihydropyrimido[5,4-d]pyrimidine
PubChem CID142421412
Molecular FormulaC6H6N4
Molecular Weight134.14 g/mol
Exact Mass134.06
IUPAC Name1,5-dihydropyrimido[5,4-d]pyrimidine
SMILESC1=NC=C2NC=NC=C2N1
InChIInChI=1S/C6H6N4/c1-5-6(10-3-7-1)2-8-4-9-5/h1-4H,(H,7,10)(H,8,9)
InChIKeyDJBRGSRRHLPVTQ-UHFFFAOYSA-N
XLogP-0.07
TPSA48.78 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.14
LogP ≤ 5-0.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1,5-dihydropyrimido[5,4-d]pyrimidine?
The IUPAC name of 1,5-dihydropyrimido[5,4-d]pyrimidine (CID 142421412) is 1,5-dihydropyrimido[5,4-d]pyrimidine.
What is the SMILES notation for 1,5-dihydropyrimido[5,4-d]pyrimidine?
The canonical SMILES for 1,5-dihydropyrimido[5,4-d]pyrimidine is C1=NC=C2NC=NC=C2N1.
What is the InChIKey of 1,5-dihydropyrimido[5,4-d]pyrimidine?
The InChIKey is DJBRGSRRHLPVTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6N4/c1-5-6(10-3-7-1)2-8-4-9-5/h1-4H,(H,7,10)(H,8,9).
What are the key properties of 1,5-dihydropyrimido[5,4-d]pyrimidine?
1,5-dihydropyrimido[5,4-d]pyrimidine has a molecular weight of 134.14 g/mol, XLogP of -0.07, 0 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5-dihydropyrimido[5,4-d]pyrimidine is sourced from PubChem (CID 142421412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).