2-methyl-3,4-dihydro-2H-pyrimido[5,4-e][1,3]oxazine

C7H9N3O — CID 175727535

IUPAC2-methyl-3,4-dihydro-2H-pyrimido[5,4-e][1,3]oxazine
SMILESCC1NCc2cncnc2O1
InChIInChI=1S/C7H9N3O/c1-5-9-3-6-2-8-4-10-7(6)11-5/h2,4-5,9H,3H2,1H3
InChIKeyRTIIWHJJENVFIC-UHFFFAOYSA-N
MW151.17 g/mol
LogP0.30
Rot. Bonds

About 2-methyl-3,4-dihydro-2H-pyrimido[5,4-e][1,3]oxazine

2-methyl-3,4-dihydro-2H-pyrimido[5,4-e][1,3]oxazine (PubChem CID 175727535) has the molecular formula C7H9N3O and a molecular weight of 151.17 g/mol. Its IUPAC name is 2-methyl-3,4-dihydro-2H-pyrimido[5,4-e][1,3]oxazine.

Molecular Properties

Compound Name2-methyl-3,4-dihydro-2H-pyrimido[5,4-e][1,3]oxazine
PubChem CID175727535
Molecular FormulaC7H9N3O
Molecular Weight151.17 g/mol
Exact Mass151.07
IUPAC Name2-methyl-3,4-dihydro-2H-pyrimido[5,4-e][1,3]oxazine
SMILESCC1NCc2cncnc2O1
InChIInChI=1S/C7H9N3O/c1-5-9-3-6-2-8-4-10-7(6)11-5/h2,4-5,9H,3H2,1H3
InChIKeyRTIIWHJJENVFIC-UHFFFAOYSA-N
XLogP0.30
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.17
LogP ≤ 50.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-methyl-2,3-dihydropyrimido[5,4-e][1,3]oxazin-4-one
CID 175727554
7,7-dimethyl-5,6-dihydropyrrolo[3,4-d]pyrimidine;dihydrochloride
CID 71743448
(6aS,10aS)-5,6,6a,7,8,9,10,10a-octahydropyrimido[5,4-c]quinoline
CID 125451162
1-methyl-2,3-dihydro-1H-pyrrolo[3,4-c]pyridine
CID 68632230
5,6,7,8-tetrahydropyrido[3,4-d]pyrimidine;hydrochloride
CID 22707087
(3S)-3-methyl-7-pyrimidin-5-yl-2,3,4,5-tetrahydro-1,4-benzoxazepine
CID 172908762
3,4-dihydro-1H-pyrimido[4,5-c]oxazine
CID 45080114
6,7,8,9-tetrahydro-5H-pyrimido[4,5-c]azepine
CID 67414259
3,4-dihydro-1H-pyrimido[4,5-d]pyrimidine-2-thione
CID 4311777
7-propan-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidine
CID 58752904
3-fluoro-7-methyl-6,7-dihydro-5H-pyrrolo[3,4-b]pyridine;dihydrochloride
CID 135396930
(3S)-7-chloro-3-methyl-1,2,3,4-tetrahydro-2,6-naphthyridine
CID 163219599

Frequently Asked Questions

What is the IUPAC name of 2-methyl-3,4-dihydro-2H-pyrimido[5,4-e][1,3]oxazine?
The IUPAC name of 2-methyl-3,4-dihydro-2H-pyrimido[5,4-e][1,3]oxazine (CID 175727535) is 2-methyl-3,4-dihydro-2H-pyrimido[5,4-e][1,3]oxazine.
What is the SMILES notation for 2-methyl-3,4-dihydro-2H-pyrimido[5,4-e][1,3]oxazine?
The canonical SMILES for 2-methyl-3,4-dihydro-2H-pyrimido[5,4-e][1,3]oxazine is CC1NCc2cncnc2O1.
What is the InChIKey of 2-methyl-3,4-dihydro-2H-pyrimido[5,4-e][1,3]oxazine?
The InChIKey is RTIIWHJJENVFIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N3O/c1-5-9-3-6-2-8-4-10-7(6)11-5/h2,4-5,9H,3H2,1H3.
What are the key properties of 2-methyl-3,4-dihydro-2H-pyrimido[5,4-e][1,3]oxazine?
2-methyl-3,4-dihydro-2H-pyrimido[5,4-e][1,3]oxazine has a molecular weight of 151.17 g/mol, XLogP of 0.30, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3,4-dihydro-2H-pyrimido[5,4-e][1,3]oxazine is sourced from PubChem (CID 175727535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).