3-amino-2-methylpyrido[1,2-a]pyrimidin-4-one;hydrochloride

C9H10ClN3O — CID 2879264

IUPAC3-amino-2-methylpyrido[1,2-a]pyrimidin-4-one;hydrochloride
SMILESCc1nc2ccccn2c(=O)c1N.Cl
InChIInChI=1S/C9H9N3O.ClH/c1-6-8(10)9(13)12-5-3-2-4-7(12)11-6;/h2-5H,10H2,1H3;1H
InChIKeyBHBBZHNNZNYEBA-UHFFFAOYSA-N
MW211.65 g/mol
LogP1.01
Rot. Bonds

About 3-amino-2-methylpyrido[1,2-a]pyrimidin-4-one;hydrochloride

3-amino-2-methylpyrido[1,2-a]pyrimidin-4-one;hydrochloride (PubChem CID 2879264) has the molecular formula C9H10ClN3O and a molecular weight of 211.65 g/mol. Its IUPAC name is 3-amino-2-methylpyrido[1,2-a]pyrimidin-4-one;hydrochloride.

Molecular Properties

Compound Name3-amino-2-methylpyrido[1,2-a]pyrimidin-4-one;hydrochloride
PubChem CID2879264
Molecular FormulaC9H10ClN3O
Molecular Weight211.65 g/mol
Exact Mass211.05
IUPAC Name3-amino-2-methylpyrido[1,2-a]pyrimidin-4-one;hydrochloride
SMILESCc1nc2ccccn2c(=O)c1N.Cl
InChIInChI=1S/C9H9N3O.ClH/c1-6-8(10)9(13)12-5-3-2-4-7(12)11-6;/h2-5H,10H2,1H3;1H
InChIKeyBHBBZHNNZNYEBA-UHFFFAOYSA-N
XLogP1.01
TPSA60.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.65
LogP ≤ 51.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-amino-2-methylpyrido[1,2-a]pyrimidin-4-one;hydrochloride?
The IUPAC name of 3-amino-2-methylpyrido[1,2-a]pyrimidin-4-one;hydrochloride (CID 2879264) is 3-amino-2-methylpyrido[1,2-a]pyrimidin-4-one;hydrochloride.
What is the SMILES notation for 3-amino-2-methylpyrido[1,2-a]pyrimidin-4-one;hydrochloride?
The canonical SMILES for 3-amino-2-methylpyrido[1,2-a]pyrimidin-4-one;hydrochloride is Cc1nc2ccccn2c(=O)c1N.Cl.
What is the InChIKey of 3-amino-2-methylpyrido[1,2-a]pyrimidin-4-one;hydrochloride?
The InChIKey is BHBBZHNNZNYEBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N3O.ClH/c1-6-8(10)9(13)12-5-3-2-4-7(12)11-6;/h2-5H,10H2,1H3;1H.
What are the key properties of 3-amino-2-methylpyrido[1,2-a]pyrimidin-4-one;hydrochloride?
3-amino-2-methylpyrido[1,2-a]pyrimidin-4-one;hydrochloride has a molecular weight of 211.65 g/mol, XLogP of 1.01, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-2-methylpyrido[1,2-a]pyrimidin-4-one;hydrochloride is sourced from PubChem (CID 2879264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).