2-(2-hydroxyethyl)-4-methylpyrido[3,2-b][1,4]oxazin-3-one

C10H12N2O3 — CID 116990504

IUPAC2-(2-hydroxyethyl)-4-methylpyrido[3,2-b][1,4]oxazin-3-one
SMILESCN1C(=O)C(CCO)Oc2cccnc21
InChIInChI=1S/C10H12N2O3/c1-12-9-7(3-2-5-11-9)15-8(4-6-13)10(12)14/h2-3,5,8,13H,4,6H2,1H3
InChIKeyMGMJQTADBOMSBN-UHFFFAOYSA-N
MW208.22 g/mol
LogP0.19
Rot. Bonds2

About 2-(2-hydroxyethyl)-4-methylpyrido[3,2-b][1,4]oxazin-3-one

2-(2-hydroxyethyl)-4-methylpyrido[3,2-b][1,4]oxazin-3-one (PubChem CID 116990504) has the molecular formula C10H12N2O3 and a molecular weight of 208.22 g/mol. Its IUPAC name is 2-(2-hydroxyethyl)-4-methylpyrido[3,2-b][1,4]oxazin-3-one.

Molecular Properties

Compound Name2-(2-hydroxyethyl)-4-methylpyrido[3,2-b][1,4]oxazin-3-one
PubChem CID116990504
Molecular FormulaC10H12N2O3
Molecular Weight208.22 g/mol
Exact Mass208.08
IUPAC Name2-(2-hydroxyethyl)-4-methylpyrido[3,2-b][1,4]oxazin-3-one
SMILESCN1C(=O)C(CCO)Oc2cccnc21
InChIInChI=1S/C10H12N2O3/c1-12-9-7(3-2-5-11-9)15-8(4-6-13)10(12)14/h2-3,5,8,13H,4,6H2,1H3
InChIKeyMGMJQTADBOMSBN-UHFFFAOYSA-N
XLogP0.19
TPSA62.66 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.22
LogP ≤ 50.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(1-amino-2-hydroxyethyl)-4-methylpyrido[3,2-b][1,4]oxazin-3-one
CID 116990549
2-(1-aminopropan-2-yl)-4-methylpyrido[3,2-b][1,4]oxazin-3-one
CID 116990467
2,5-dimethyl-3-(methylamino)-2,3-dihydropyrido[3,2-b][1,4]oxazepin-4-one
CID 130340591
4-methyl-2-[4-(methylamino)phenyl]pyrido[3,2-b][1,4]oxazin-3-one
CID 116990496
1-(4-methyl-3-oxopyrido[3,2-b][1,4]oxazin-2-yl)cyclopropane-1-carboxylic acid
CID 116990554
3-amino-5-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazepin-4-one;hydrochloride
CID 130298996
3-iodo-5-methylspiro[3H-pyrido[3,2-b][1,4]oxazepine-2,1'-cyclopropane]-4-one
CID 130314126
8-ethyl-9-oxa-2,14-diazatricyclo[8.4.0.02,6]tetradeca-1(10),3,5,11,13-pentaen-7-one
CID 10561307
5-benzyl-N-[(2R,3S)-2,5-dimethyl-4-oxo-2,3-dihydropyrido[3,2-b][1,4]oxazepin-3-yl]-1,3-oxazole-2-carboxamide
CID 130299225
ethane;2-(2-hydroxyethyl)-4H-1,4-benzoxazin-3-one
CID 90923836
2-ethyl-4H-pyrido[3,2-b][1,4]oxazin-3-one
CID 13087443
3-ethyl-1-methyl-3H-pyrrolo[2,3-b]pyridin-2-one
CID 10654865

Frequently Asked Questions

What is the IUPAC name of 2-(2-hydroxyethyl)-4-methylpyrido[3,2-b][1,4]oxazin-3-one?
The IUPAC name of 2-(2-hydroxyethyl)-4-methylpyrido[3,2-b][1,4]oxazin-3-one (CID 116990504) is 2-(2-hydroxyethyl)-4-methylpyrido[3,2-b][1,4]oxazin-3-one.
What is the SMILES notation for 2-(2-hydroxyethyl)-4-methylpyrido[3,2-b][1,4]oxazin-3-one?
The canonical SMILES for 2-(2-hydroxyethyl)-4-methylpyrido[3,2-b][1,4]oxazin-3-one is CN1C(=O)C(CCO)Oc2cccnc21.
What is the InChIKey of 2-(2-hydroxyethyl)-4-methylpyrido[3,2-b][1,4]oxazin-3-one?
The InChIKey is MGMJQTADBOMSBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2O3/c1-12-9-7(3-2-5-11-9)15-8(4-6-13)10(12)14/h2-3,5,8,13H,4,6H2,1H3.
What are the key properties of 2-(2-hydroxyethyl)-4-methylpyrido[3,2-b][1,4]oxazin-3-one?
2-(2-hydroxyethyl)-4-methylpyrido[3,2-b][1,4]oxazin-3-one has a molecular weight of 208.22 g/mol, XLogP of 0.19, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-hydroxyethyl)-4-methylpyrido[3,2-b][1,4]oxazin-3-one is sourced from PubChem (CID 116990504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).