8-amino-2-cyclopropylpyrido[1,2-a]pyrimidin-4-one

C11H11N3O — CID 83880936

IUPAC8-amino-2-cyclopropylpyrido[1,2-a]pyrimidin-4-one
SMILESNc1ccn2c(=O)cc(C3CC3)nc2c1
InChIInChI=1S/C11H11N3O/c12-8-3-4-14-10(5-8)13-9(6-11(14)15)7-1-2-7/h3-7H,1-2,12H2
InChIKeyBMWBMSSCACKDCS-UHFFFAOYSA-N
MW201.23 g/mol
LogP1.15
Rot. Bonds1

About 8-amino-2-cyclopropylpyrido[1,2-a]pyrimidin-4-one

8-amino-2-cyclopropylpyrido[1,2-a]pyrimidin-4-one (PubChem CID 83880936) has the molecular formula C11H11N3O and a molecular weight of 201.23 g/mol. Its IUPAC name is 8-amino-2-cyclopropylpyrido[1,2-a]pyrimidin-4-one.

Molecular Properties

Compound Name8-amino-2-cyclopropylpyrido[1,2-a]pyrimidin-4-one
PubChem CID83880936
Molecular FormulaC11H11N3O
Molecular Weight201.23 g/mol
Exact Mass201.09
IUPAC Name8-amino-2-cyclopropylpyrido[1,2-a]pyrimidin-4-one
SMILESNc1ccn2c(=O)cc(C3CC3)nc2c1
InChIInChI=1S/C11H11N3O/c12-8-3-4-14-10(5-8)13-9(6-11(14)15)7-1-2-7/h3-7H,1-2,12H2
InChIKeyBMWBMSSCACKDCS-UHFFFAOYSA-N
XLogP1.15
TPSA60.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.23
LogP ≤ 51.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2,7-Dimethylpyrido[1,2-a]pyrimidin-4-one
CID 12369824
3-Amino-2-cyclopropyl-9-(trifluoromethyl)pyrido[1,2-a]pyrimidin-4-one
CID 66825496
2-Cyclopropyl-9-(trifluoromethyl)-4H-pyrido[1,2-a]pyrimidin-4-one
CID 66825567
7-Amino-2-ethyl-9-fluoro-4H-pyrido[1,2-a]pyrimidin-4-one
CID 138958350
7-Cyclopropyl-2-(trifluoromethyl)pyrido[1,2-a]pyrimidin-4-one
CID 156409440
8-Cyclopropyl-2-(trifluoromethyl)pyrido[1,2-a]pyrimidin-4-one
CID 156409617
2-Cyclopropyl-7-fluoropyrido[1,2-a]pyrimidin-4-one
CID 176681810
2-butyl-4H-pyrido[1,2-a]pyrimidin-4-one
CID 68856685
2-(2-Aminoethyl)-9-fluoropyrido[1,2-a]pyrimidin-4-one
CID 115025026
2-(2-Aminoethyl)-8-fluoropyrido[1,2-a]pyrimidin-4-one
CID 115025027
2-(2-Aminoethyl)-7-fluoropyrido[1,2-a]pyrimidin-4-one
CID 115025028
8-Fluoro-2-pyrrolidin-3-ylpyrido[1,2-a]pyrimidin-4-one
CID 115039374

Frequently Asked Questions

What is the IUPAC name of 8-amino-2-cyclopropylpyrido[1,2-a]pyrimidin-4-one?
The IUPAC name of 8-amino-2-cyclopropylpyrido[1,2-a]pyrimidin-4-one (CID 83880936) is 8-amino-2-cyclopropylpyrido[1,2-a]pyrimidin-4-one.
What is the SMILES notation for 8-amino-2-cyclopropylpyrido[1,2-a]pyrimidin-4-one?
The canonical SMILES for 8-amino-2-cyclopropylpyrido[1,2-a]pyrimidin-4-one is Nc1ccn2c(=O)cc(C3CC3)nc2c1.
What is the InChIKey of 8-amino-2-cyclopropylpyrido[1,2-a]pyrimidin-4-one?
The InChIKey is BMWBMSSCACKDCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N3O/c12-8-3-4-14-10(5-8)13-9(6-11(14)15)7-1-2-7/h3-7H,1-2,12H2.
What are the key properties of 8-amino-2-cyclopropylpyrido[1,2-a]pyrimidin-4-one?
8-amino-2-cyclopropylpyrido[1,2-a]pyrimidin-4-one has a molecular weight of 201.23 g/mol, XLogP of 1.15, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-amino-2-cyclopropylpyrido[1,2-a]pyrimidin-4-one is sourced from PubChem (CID 83880936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).