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

C9H10N2O — CID 172849376

IUPAC9-methyl-4H-pyrido[1,2-a]pyrimidin-2-ol
SMILESCC1=CC=CN2CC=C(O)N=C12
InChIInChI=1S/C9H10N2O/c1-7-3-2-5-11-6-4-8(12)10-9(7)11/h2-5,12H,6H2,1H3
InChIKeyXVYXIOIVJCLAHF-UHFFFAOYSA-N
MW162.19 g/mol
LogP1.57
Rot. Bonds

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

9-methyl-4H-pyrido[1,2-a]pyrimidin-2-ol (PubChem CID 172849376) has the molecular formula C9H10N2O and a molecular weight of 162.19 g/mol. Its IUPAC name is 9-methyl-4H-pyrido[1,2-a]pyrimidin-2-ol.

Molecular Properties

Compound Name9-methyl-4H-pyrido[1,2-a]pyrimidin-2-ol
PubChem CID172849376
Molecular FormulaC9H10N2O
Molecular Weight162.19 g/mol
Exact Mass162.08
IUPAC Name9-methyl-4H-pyrido[1,2-a]pyrimidin-2-ol
SMILESCC1=CC=CN2CC=C(O)N=C12
InChIInChI=1S/C9H10N2O/c1-7-3-2-5-11-6-4-8(12)10-9(7)11/h2-5,12H,6H2,1H3
InChIKeyXVYXIOIVJCLAHF-UHFFFAOYSA-N
XLogP1.57
TPSA35.83 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.19
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 9-methyl-4H-pyrido[1,2-a]pyrimidin-2-ol?
The IUPAC name of 9-methyl-4H-pyrido[1,2-a]pyrimidin-2-ol (CID 172849376) is 9-methyl-4H-pyrido[1,2-a]pyrimidin-2-ol.
What is the SMILES notation for 9-methyl-4H-pyrido[1,2-a]pyrimidin-2-ol?
The canonical SMILES for 9-methyl-4H-pyrido[1,2-a]pyrimidin-2-ol is CC1=CC=CN2CC=C(O)N=C12.
What is the InChIKey of 9-methyl-4H-pyrido[1,2-a]pyrimidin-2-ol?
The InChIKey is XVYXIOIVJCLAHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2O/c1-7-3-2-5-11-6-4-8(12)10-9(7)11/h2-5,12H,6H2,1H3.
What are the key properties of 9-methyl-4H-pyrido[1,2-a]pyrimidin-2-ol?
9-methyl-4H-pyrido[1,2-a]pyrimidin-2-ol has a molecular weight of 162.19 g/mol, XLogP of 1.57, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-methyl-4H-pyrido[1,2-a]pyrimidin-2-ol is sourced from PubChem (CID 172849376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).