1,3-dihydroimidazo[1,2-c]pyrimidine-2,7-dione

C6H5N3O2 — CID 70453266

IUPAC1,3-dihydroimidazo[1,2-c]pyrimidine-2,7-dione
SMILESO=C1Cn2cnc(=O)cc2N1
InChIInChI=1S/C6H5N3O2/c10-5-1-4-8-6(11)2-9(4)3-7-5/h1,3H,2H2,(H,8,11)
InChIKeyLBQVNVBCKAPUQY-UHFFFAOYSA-N
MW151.12 g/mol
LogP-0.80
Rot. Bonds

About 1,3-dihydroimidazo[1,2-c]pyrimidine-2,7-dione

1,3-dihydroimidazo[1,2-c]pyrimidine-2,7-dione (PubChem CID 70453266) has the molecular formula C6H5N3O2 and a molecular weight of 151.12 g/mol. Its IUPAC name is 1,3-dihydroimidazo[1,2-c]pyrimidine-2,7-dione.

Molecular Properties

Compound Name1,3-dihydroimidazo[1,2-c]pyrimidine-2,7-dione
PubChem CID70453266
Molecular FormulaC6H5N3O2
Molecular Weight151.12 g/mol
Exact Mass151.04
IUPAC Name1,3-dihydroimidazo[1,2-c]pyrimidine-2,7-dione
SMILESO=C1Cn2cnc(=O)cc2N1
InChIInChI=1S/C6H5N3O2/c10-5-1-4-8-6(11)2-9(4)3-7-5/h1,3H,2H2,(H,8,11)
InChIKeyLBQVNVBCKAPUQY-UHFFFAOYSA-N
XLogP-0.80
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.12
LogP ≤ 5-0.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1,3-dihydroimidazo[1,2-c]pyrimidine-2,7-dione?
The IUPAC name of 1,3-dihydroimidazo[1,2-c]pyrimidine-2,7-dione (CID 70453266) is 1,3-dihydroimidazo[1,2-c]pyrimidine-2,7-dione.
What is the SMILES notation for 1,3-dihydroimidazo[1,2-c]pyrimidine-2,7-dione?
The canonical SMILES for 1,3-dihydroimidazo[1,2-c]pyrimidine-2,7-dione is O=C1Cn2cnc(=O)cc2N1.
What is the InChIKey of 1,3-dihydroimidazo[1,2-c]pyrimidine-2,7-dione?
The InChIKey is LBQVNVBCKAPUQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5N3O2/c10-5-1-4-8-6(11)2-9(4)3-7-5/h1,3H,2H2,(H,8,11).
What are the key properties of 1,3-dihydroimidazo[1,2-c]pyrimidine-2,7-dione?
1,3-dihydroimidazo[1,2-c]pyrimidine-2,7-dione has a molecular weight of 151.12 g/mol, XLogP of -0.80, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-dihydroimidazo[1,2-c]pyrimidine-2,7-dione is sourced from PubChem (CID 70453266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).