9-methyl-3,4-dihydro-2H-pyrido[1,2-a]pyrimidin-3-ol

C9H12N2O — CID 659370

IUPAC9-methyl-3,4-dihydro-2H-pyrido[1,2-a]pyrimidin-3-ol
SMILESCC1=CC=CN2CC(O)CN=C12
InChIInChI=1S/C9H12N2O/c1-7-3-2-4-11-6-8(12)5-10-9(7)11/h2-4,8,12H,5-6H2,1H3
InChIKeyDELOXTZBUOKDFV-UHFFFAOYSA-N
MW164.21 g/mol
LogP0.54
Rot. Bonds

About 9-methyl-3,4-dihydro-2H-pyrido[1,2-a]pyrimidin-3-ol

9-methyl-3,4-dihydro-2H-pyrido[1,2-a]pyrimidin-3-ol (PubChem CID 659370) has the molecular formula C9H12N2O and a molecular weight of 164.21 g/mol. Its IUPAC name is 9-methyl-3,4-dihydro-2H-pyrido[1,2-a]pyrimidin-3-ol.

Molecular Properties

Compound Name9-methyl-3,4-dihydro-2H-pyrido[1,2-a]pyrimidin-3-ol
PubChem CID659370
Molecular FormulaC9H12N2O
Molecular Weight164.21 g/mol
Exact Mass164.09
IUPAC Name9-methyl-3,4-dihydro-2H-pyrido[1,2-a]pyrimidin-3-ol
SMILESCC1=CC=CN2CC(O)CN=C12
InChIInChI=1S/C9H12N2O/c1-7-3-2-4-11-6-8(12)5-10-9(7)11/h2-4,8,12H,5-6H2,1H3
InChIKeyDELOXTZBUOKDFV-UHFFFAOYSA-N
XLogP0.54
TPSA35.83 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.21
LogP ≤ 50.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 9-methyl-3,4-dihydro-2H-pyrido[1,2-a]pyrimidin-3-ol?
The IUPAC name of 9-methyl-3,4-dihydro-2H-pyrido[1,2-a]pyrimidin-3-ol (CID 659370) is 9-methyl-3,4-dihydro-2H-pyrido[1,2-a]pyrimidin-3-ol.
What is the SMILES notation for 9-methyl-3,4-dihydro-2H-pyrido[1,2-a]pyrimidin-3-ol?
The canonical SMILES for 9-methyl-3,4-dihydro-2H-pyrido[1,2-a]pyrimidin-3-ol is CC1=CC=CN2CC(O)CN=C12.
What is the InChIKey of 9-methyl-3,4-dihydro-2H-pyrido[1,2-a]pyrimidin-3-ol?
The InChIKey is DELOXTZBUOKDFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2O/c1-7-3-2-4-11-6-8(12)5-10-9(7)11/h2-4,8,12H,5-6H2,1H3.
What are the key properties of 9-methyl-3,4-dihydro-2H-pyrido[1,2-a]pyrimidin-3-ol?
9-methyl-3,4-dihydro-2H-pyrido[1,2-a]pyrimidin-3-ol has a molecular weight of 164.21 g/mol, XLogP of 0.54, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-methyl-3,4-dihydro-2H-pyrido[1,2-a]pyrimidin-3-ol is sourced from PubChem (CID 659370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).