1-[5,6-dimethyl-4-(3-methylphenyl)-6H-1,3-oxazin-2-yl]ethanamine

C15H20N2O — CID 155718614

IUPAC1-[5,6-dimethyl-4-(3-methylphenyl)-6H-1,3-oxazin-2-yl]ethanamine
SMILESCC1=C(c2cccc(C)c2)N=C(C(C)N)OC1C
InChIInChI=1S/C15H20N2O/c1-9-6-5-7-13(8-9)14-10(2)12(4)18-15(17-14)11(3)16/h5-8,11-12H,16H2,1-4H3
InChIKeyAKLMOLPQSIAAGP-UHFFFAOYSA-N
MW244.34 g/mol
LogP2.89
Rot. Bonds2

About 1-[5,6-dimethyl-4-(3-methylphenyl)-6H-1,3-oxazin-2-yl]ethanamine

1-[5,6-dimethyl-4-(3-methylphenyl)-6H-1,3-oxazin-2-yl]ethanamine (PubChem CID 155718614) has the molecular formula C15H20N2O and a molecular weight of 244.34 g/mol. Its IUPAC name is 1-[5,6-dimethyl-4-(3-methylphenyl)-6H-1,3-oxazin-2-yl]ethanamine.

Molecular Properties

Compound Name1-[5,6-dimethyl-4-(3-methylphenyl)-6H-1,3-oxazin-2-yl]ethanamine
PubChem CID155718614
Molecular FormulaC15H20N2O
Molecular Weight244.34 g/mol
Exact Mass244.16
IUPAC Name1-[5,6-dimethyl-4-(3-methylphenyl)-6H-1,3-oxazin-2-yl]ethanamine
SMILESCC1=C(c2cccc(C)c2)N=C(C(C)N)OC1C
InChIInChI=1S/C15H20N2O/c1-9-6-5-7-13(8-9)14-10(2)12(4)18-15(17-14)11(3)16/h5-8,11-12H,16H2,1-4H3
InChIKeyAKLMOLPQSIAAGP-UHFFFAOYSA-N
XLogP2.89
TPSA47.61 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[4-(3-fluorophenyl)-6H-1,3-oxazin-2-yl]methanamine
CID 155718667
methyl 2-amino-N-[1-(3-fluorophenyl)-2-methylprop-1-enyl]propanimidate
CID 156843898
(1S)-1-[4-(3-fluorophenyl)-6H-1,3-oxazin-2-yl]ethanamine
CID 163490539
(Z)-2-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-1-(3-methylphenyl)ethenamine
CID 101024184
(1S)-4-[1-[1-(5-amino-4-propan-2-yloxycyclohexa-1,5-dien-1-yl)ethylideneamino]ethenyl]-2,3-dihydro-1H-inden-1-amine
CID 88945398
N-[[4-[3-[C-ethyl-N-[(4E)-4-methyl-2,3-dihydroazocin-5-yl]carbonimidoyl]phenyl]-5,6-dimethyl-6H-1,3-oxazin-2-yl]methyl]ethanamine
CID 123381590
2-[(4S)-4-tert-butyl-4,5-dihydro-1,3-oxazol-2-yl]-1-phenylethenamine
CID 139716124
ethyl (2R)-2-amino-N-benzyl-3-methylbutanimidate
CID 142882762
4-Benzylimino-1-methoxy-3-methylbut-2-en-2-amine
CID 149179096
methyl 2-amino-N-[2-methyl-1-(3-methylphenyl)prop-1-enyl]butanimidate
CID 155718475
methyl 2-amino-N-[2-methyl-1-(3-methylphenyl)prop-1-enyl]propanimidate
CID 155718564
(E)-2-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-1-(3-methylphenyl)ethenamine
CID 10657101

Frequently Asked Questions

What is the IUPAC name of 1-[5,6-dimethyl-4-(3-methylphenyl)-6H-1,3-oxazin-2-yl]ethanamine?
The IUPAC name of 1-[5,6-dimethyl-4-(3-methylphenyl)-6H-1,3-oxazin-2-yl]ethanamine (CID 155718614) is 1-[5,6-dimethyl-4-(3-methylphenyl)-6H-1,3-oxazin-2-yl]ethanamine.
What is the SMILES notation for 1-[5,6-dimethyl-4-(3-methylphenyl)-6H-1,3-oxazin-2-yl]ethanamine?
The canonical SMILES for 1-[5,6-dimethyl-4-(3-methylphenyl)-6H-1,3-oxazin-2-yl]ethanamine is CC1=C(c2cccc(C)c2)N=C(C(C)N)OC1C.
What is the InChIKey of 1-[5,6-dimethyl-4-(3-methylphenyl)-6H-1,3-oxazin-2-yl]ethanamine?
The InChIKey is AKLMOLPQSIAAGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O/c1-9-6-5-7-13(8-9)14-10(2)12(4)18-15(17-14)11(3)16/h5-8,11-12H,16H2,1-4H3.
What are the key properties of 1-[5,6-dimethyl-4-(3-methylphenyl)-6H-1,3-oxazin-2-yl]ethanamine?
1-[5,6-dimethyl-4-(3-methylphenyl)-6H-1,3-oxazin-2-yl]ethanamine has a molecular weight of 244.34 g/mol, XLogP of 2.89, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5,6-dimethyl-4-(3-methylphenyl)-6H-1,3-oxazin-2-yl]ethanamine is sourced from PubChem (CID 155718614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).