3,4-dihydro-2H-pyrido[1,2-a]pyrimidine;hydrobromide

C8H11BrN2 — CID 71316203

IUPAC3,4-dihydro-2H-pyrido[1,2-a]pyrimidine;hydrobromide
SMILESBr.C1=CC2=NCCCN2C=C1
InChIInChI=1S/C8H10N2.BrH/c1-2-6-10-7-3-5-9-8(10)4-1;/h1-2,4,6H,3,5,7H2;1H
InChIKeyQIJIQJJOUYATTM-UHFFFAOYSA-N
MW215.09 g/mol
LogP1.75
Rot. Bonds

About 3,4-dihydro-2H-pyrido[1,2-a]pyrimidine;hydrobromide

3,4-dihydro-2H-pyrido[1,2-a]pyrimidine;hydrobromide (PubChem CID 71316203) has the molecular formula C8H11BrN2 and a molecular weight of 215.09 g/mol. Its IUPAC name is 3,4-dihydro-2H-pyrido[1,2-a]pyrimidine;hydrobromide.

Molecular Properties

Compound Name3,4-dihydro-2H-pyrido[1,2-a]pyrimidine;hydrobromide
PubChem CID71316203
Molecular FormulaC8H11BrN2
Molecular Weight215.09 g/mol
Exact Mass214.01
IUPAC Name3,4-dihydro-2H-pyrido[1,2-a]pyrimidine;hydrobromide
SMILESBr.C1=CC2=NCCCN2C=C1
InChIInChI=1S/C8H10N2.BrH/c1-2-6-10-7-3-5-9-8(10)4-1;/h1-2,4,6H,3,5,7H2;1H
InChIKeyQIJIQJJOUYATTM-UHFFFAOYSA-N
XLogP1.75
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.09
LogP ≤ 51.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3,4-dihydro-2H-pyrido[1,2-a]pyrimidine;hydrobromide?
The IUPAC name of 3,4-dihydro-2H-pyrido[1,2-a]pyrimidine;hydrobromide (CID 71316203) is 3,4-dihydro-2H-pyrido[1,2-a]pyrimidine;hydrobromide.
What is the SMILES notation for 3,4-dihydro-2H-pyrido[1,2-a]pyrimidine;hydrobromide?
The canonical SMILES for 3,4-dihydro-2H-pyrido[1,2-a]pyrimidine;hydrobromide is Br.C1=CC2=NCCCN2C=C1.
What is the InChIKey of 3,4-dihydro-2H-pyrido[1,2-a]pyrimidine;hydrobromide?
The InChIKey is QIJIQJJOUYATTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2.BrH/c1-2-6-10-7-3-5-9-8(10)4-1;/h1-2,4,6H,3,5,7H2;1H.
What are the key properties of 3,4-dihydro-2H-pyrido[1,2-a]pyrimidine;hydrobromide?
3,4-dihydro-2H-pyrido[1,2-a]pyrimidine;hydrobromide has a molecular weight of 215.09 g/mol, XLogP of 1.75, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dihydro-2H-pyrido[1,2-a]pyrimidine;hydrobromide is sourced from PubChem (CID 71316203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).