pyrido[1,2-a]pyrimidin-2-one;hydrobromide

C8H7BrN2O — CID 23460792

IUPACpyrido[1,2-a]pyrimidin-2-one;hydrobromide
SMILESBr.O=c1ccn2ccccc2n1
InChIInChI=1S/C8H6N2O.BrH/c11-8-4-6-10-5-2-1-3-7(10)9-8;/h1-6H;1H
InChIKeyJYNVXRWLUNBOCU-UHFFFAOYSA-N
MW227.06 g/mol
LogP1.27
Rot. Bonds

About pyrido[1,2-a]pyrimidin-2-one;hydrobromide

pyrido[1,2-a]pyrimidin-2-one;hydrobromide (PubChem CID 23460792) has the molecular formula C8H7BrN2O and a molecular weight of 227.06 g/mol. Its IUPAC name is pyrido[1,2-a]pyrimidin-2-one;hydrobromide.

Molecular Properties

Compound Namepyrido[1,2-a]pyrimidin-2-one;hydrobromide
PubChem CID23460792
Molecular FormulaC8H7BrN2O
Molecular Weight227.06 g/mol
Exact Mass225.97
IUPAC Namepyrido[1,2-a]pyrimidin-2-one;hydrobromide
SMILESBr.O=c1ccn2ccccc2n1
InChIInChI=1S/C8H6N2O.BrH/c11-8-4-6-10-5-2-1-3-7(10)9-8;/h1-6H;1H
InChIKeyJYNVXRWLUNBOCU-UHFFFAOYSA-N
XLogP1.27
TPSA34.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.06
LogP ≤ 51.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of pyrido[1,2-a]pyrimidin-2-one;hydrobromide?
The IUPAC name of pyrido[1,2-a]pyrimidin-2-one;hydrobromide (CID 23460792) is pyrido[1,2-a]pyrimidin-2-one;hydrobromide.
What is the SMILES notation for pyrido[1,2-a]pyrimidin-2-one;hydrobromide?
The canonical SMILES for pyrido[1,2-a]pyrimidin-2-one;hydrobromide is Br.O=c1ccn2ccccc2n1.
What is the InChIKey of pyrido[1,2-a]pyrimidin-2-one;hydrobromide?
The InChIKey is JYNVXRWLUNBOCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6N2O.BrH/c11-8-4-6-10-5-2-1-3-7(10)9-8;/h1-6H;1H.
What are the key properties of pyrido[1,2-a]pyrimidin-2-one;hydrobromide?
pyrido[1,2-a]pyrimidin-2-one;hydrobromide has a molecular weight of 227.06 g/mol, XLogP of 1.27, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for pyrido[1,2-a]pyrimidin-2-one;hydrobromide is sourced from PubChem (CID 23460792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).