7-amino-2,3-dihydro-1H-imidazo[1,2-a]pyrimidin-5-one

C6H8N4O — CID 136923867

IUPAC7-amino-2,3-dihydro-1H-imidazo[1,2-a]pyrimidin-5-one
SMILESNc1cc(=O)n2c(n1)NCC2
InChIInChI=1S/C6H8N4O/c7-4-3-5(11)10-2-1-8-6(10)9-4/h3H,1-2,7H2,(H,8,9)
InChIKeyVJJMZRVJUINTCQ-UHFFFAOYSA-N
MW152.16 g/mol
LogP-0.75
Rot. Bonds

About 7-amino-2,3-dihydro-1H-imidazo[1,2-a]pyrimidin-5-one

7-amino-2,3-dihydro-1H-imidazo[1,2-a]pyrimidin-5-one (PubChem CID 136923867) has the molecular formula C6H8N4O and a molecular weight of 152.16 g/mol. Its IUPAC name is 7-amino-2,3-dihydro-1H-imidazo[1,2-a]pyrimidin-5-one.

Molecular Properties

Compound Name7-amino-2,3-dihydro-1H-imidazo[1,2-a]pyrimidin-5-one
PubChem CID136923867
Molecular FormulaC6H8N4O
Molecular Weight152.16 g/mol
Exact Mass152.07
IUPAC Name7-amino-2,3-dihydro-1H-imidazo[1,2-a]pyrimidin-5-one
SMILESNc1cc(=O)n2c(n1)NCC2
InChIInChI=1S/C6H8N4O/c7-4-3-5(11)10-2-1-8-6(10)9-4/h3H,1-2,7H2,(H,8,9)
InChIKeyVJJMZRVJUINTCQ-UHFFFAOYSA-N
XLogP-0.75
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.16
LogP ≤ 5-0.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 7-amino-2,3-dihydro-1H-imidazo[1,2-a]pyrimidin-5-one?
The IUPAC name of 7-amino-2,3-dihydro-1H-imidazo[1,2-a]pyrimidin-5-one (CID 136923867) is 7-amino-2,3-dihydro-1H-imidazo[1,2-a]pyrimidin-5-one.
What is the SMILES notation for 7-amino-2,3-dihydro-1H-imidazo[1,2-a]pyrimidin-5-one?
The canonical SMILES for 7-amino-2,3-dihydro-1H-imidazo[1,2-a]pyrimidin-5-one is Nc1cc(=O)n2c(n1)NCC2.
What is the InChIKey of 7-amino-2,3-dihydro-1H-imidazo[1,2-a]pyrimidin-5-one?
The InChIKey is VJJMZRVJUINTCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N4O/c7-4-3-5(11)10-2-1-8-6(10)9-4/h3H,1-2,7H2,(H,8,9).
What are the key properties of 7-amino-2,3-dihydro-1H-imidazo[1,2-a]pyrimidin-5-one?
7-amino-2,3-dihydro-1H-imidazo[1,2-a]pyrimidin-5-one has a molecular weight of 152.16 g/mol, XLogP of -0.75, 0 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-amino-2,3-dihydro-1H-imidazo[1,2-a]pyrimidin-5-one is sourced from PubChem (CID 136923867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).