1-(4-methoxy-2,6-dimethylphenyl)-7-methyl-5-propyl-2,4-dihydropyrimido[4,5-d][1,3]oxazine

C19H25N3O2 — CID 91298589

IUPAC1-(4-methoxy-2,6-dimethylphenyl)-7-methyl-5-propyl-2,4-dihydropyrimido[4,5-d][1,3]oxazine
SMILESCCCc1nc(C)nc2c1COCN2c1c(C)cc(OC)cc1C
InChIInChI=1S/C19H25N3O2/c1-6-7-17-16-10-24-11-22(19(16)21-14(4)20-17)18-12(2)8-15(23-5)9-13(18)3/h8-9H,6-7,10-11H2,1-5H3
InChIKeyRIJIGKXBJGIJLD-UHFFFAOYSA-N
MW327.43 g/mol
LogP3.99
Rot. Bonds4

About 1-(4-methoxy-2,6-dimethylphenyl)-7-methyl-5-propyl-2,4-dihydropyrimido[4,5-d][1,3]oxazine

1-(4-methoxy-2,6-dimethylphenyl)-7-methyl-5-propyl-2,4-dihydropyrimido[4,5-d][1,3]oxazine (PubChem CID 91298589) has the molecular formula C19H25N3O2 and a molecular weight of 327.43 g/mol. Its IUPAC name is 1-(4-methoxy-2,6-dimethylphenyl)-7-methyl-5-propyl-2,4-dihydropyrimido[4,5-d][1,3]oxazine.

Molecular Properties

Compound Name1-(4-methoxy-2,6-dimethylphenyl)-7-methyl-5-propyl-2,4-dihydropyrimido[4,5-d][1,3]oxazine
PubChem CID91298589
Molecular FormulaC19H25N3O2
Molecular Weight327.43 g/mol
Exact Mass327.19
IUPAC Name1-(4-methoxy-2,6-dimethylphenyl)-7-methyl-5-propyl-2,4-dihydropyrimido[4,5-d][1,3]oxazine
SMILESCCCc1nc(C)nc2c1COCN2c1c(C)cc(OC)cc1C
InChIInChI=1S/C19H25N3O2/c1-6-7-17-16-10-24-11-22(19(16)21-14(4)20-17)18-12(2)8-15(23-5)9-13(18)3/h8-9H,6-7,10-11H2,1-5H3
InChIKeyRIJIGKXBJGIJLD-UHFFFAOYSA-N
XLogP3.99
TPSA47.48 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.43
LogP ≤ 53.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 1-(4-methoxy-2,6-dimethylphenyl)-7-methyl-5-propyl-2,4-dihydropyrimido[4,5-d][1,3]oxazine with MolForge

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Related Compounds

1-(4-methoxy-2,6-dimethylphenyl)-3-methylpiperidin-2-one;yttrium
CID 158558111
N-ethyl-4-methoxy-2,6-dimethylaniline
CID 23348858
1-[7-(4-methoxy-2,6-dimethylphenyl)-2,5,6-trimethylpyrrolo[2,3-d]pyrimidin-4-yl]propan-1-one
CID 90909563
(3R)-6-methoxy-3-undecyl-3,4-dihydro-1H-isochromen-8-ol
CID 163072146
ethane;ethyl-[1-(4-methoxy-2,6-dimethylphenyl)-2-oxopiperidin-3-yl]-methyl-propylazanium
CID 155693222
5-chloro-3-(5-methoxy-7-methyl-2,3-dihydroindol-1-yl)-1-pentan-3-ylpyrazin-2-one
CID 10292096
(5-butyl-2-oxido-4,5-dihydro-1,2-oxazol-2-ium-3-yl)-(4-methoxyphenyl)methanone
CID 10333717
2H-Imidazol-2-ylidene, 1,3-dihydro-1,3-bis(4-methoxy-2,6-dimethylphenyl)-4,5-dimethyl-
CID 162419357
6-N-ethyl-4-N-[(4-methoxyphenyl)methyl]-2-methylpyrimidine-4,6-diamine
CID 80785216
4-(3,5-dimethoxyphenyl)-5-methyl-2-propyl-1H-pyrimidin-6-one
CID 136769485
5-bromo-N-ethyl-2-(3-methoxyphenyl)-6-propylpyrimidin-4-amine
CID 66307154
3-(4-methoxy-2,6-dimethylphenyl)-5-methyl-1,2,4-oxadiazole
CID 13237457

Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxy-2,6-dimethylphenyl)-7-methyl-5-propyl-2,4-dihydropyrimido[4,5-d][1,3]oxazine?
The IUPAC name of 1-(4-methoxy-2,6-dimethylphenyl)-7-methyl-5-propyl-2,4-dihydropyrimido[4,5-d][1,3]oxazine (CID 91298589) is 1-(4-methoxy-2,6-dimethylphenyl)-7-methyl-5-propyl-2,4-dihydropyrimido[4,5-d][1,3]oxazine.
What is the SMILES notation for 1-(4-methoxy-2,6-dimethylphenyl)-7-methyl-5-propyl-2,4-dihydropyrimido[4,5-d][1,3]oxazine?
The canonical SMILES for 1-(4-methoxy-2,6-dimethylphenyl)-7-methyl-5-propyl-2,4-dihydropyrimido[4,5-d][1,3]oxazine is CCCc1nc(C)nc2c1COCN2c1c(C)cc(OC)cc1C.
What is the InChIKey of 1-(4-methoxy-2,6-dimethylphenyl)-7-methyl-5-propyl-2,4-dihydropyrimido[4,5-d][1,3]oxazine?
The InChIKey is RIJIGKXBJGIJLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O2/c1-6-7-17-16-10-24-11-22(19(16)21-14(4)20-17)18-12(2)8-15(23-5)9-13(18)3/h8-9H,6-7,10-11H2,1-5H3.
What are the key properties of 1-(4-methoxy-2,6-dimethylphenyl)-7-methyl-5-propyl-2,4-dihydropyrimido[4,5-d][1,3]oxazine?
1-(4-methoxy-2,6-dimethylphenyl)-7-methyl-5-propyl-2,4-dihydropyrimido[4,5-d][1,3]oxazine has a molecular weight of 327.43 g/mol, XLogP of 3.99, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxy-2,6-dimethylphenyl)-7-methyl-5-propyl-2,4-dihydropyrimido[4,5-d][1,3]oxazine is sourced from PubChem (CID 91298589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).