1-(2-methoxy-4,6-dimethylphenyl)-2-methyl-2-morpholin-4-ylpropan-1-amine

C17H28N2O2 — CID 106680717

IUPAC1-(2-methoxy-4,6-dimethylphenyl)-2-methyl-2-morpholin-4-ylpropan-1-amine
SMILESCOc1cc(C)cc(C)c1C(N)C(C)(C)N1CCOCC1
InChIInChI=1S/C17H28N2O2/c1-12-10-13(2)15(14(11-12)20-5)16(18)17(3,4)19-6-8-21-9-7-19/h10-11,16H,6-9,18H2,1-5H3
InChIKeyQSSXGDVUUVUMNB-UHFFFAOYSA-N
MW292.42 g/mol
LogP2.42
Rot. Bonds4

About 1-(2-methoxy-4,6-dimethylphenyl)-2-methyl-2-morpholin-4-ylpropan-1-amine

1-(2-methoxy-4,6-dimethylphenyl)-2-methyl-2-morpholin-4-ylpropan-1-amine (PubChem CID 106680717) has the molecular formula C17H28N2O2 and a molecular weight of 292.42 g/mol. Its IUPAC name is 1-(2-methoxy-4,6-dimethylphenyl)-2-methyl-2-morpholin-4-ylpropan-1-amine.

Molecular Properties

Compound Name1-(2-methoxy-4,6-dimethylphenyl)-2-methyl-2-morpholin-4-ylpropan-1-amine
PubChem CID106680717
Molecular FormulaC17H28N2O2
Molecular Weight292.42 g/mol
Exact Mass292.22
IUPAC Name1-(2-methoxy-4,6-dimethylphenyl)-2-methyl-2-morpholin-4-ylpropan-1-amine
SMILESCOc1cc(C)cc(C)c1C(N)C(C)(C)N1CCOCC1
InChIInChI=1S/C17H28N2O2/c1-12-10-13(2)15(14(11-12)20-5)16(18)17(3,4)19-6-8-21-9-7-19/h10-11,16H,6-9,18H2,1-5H3
InChIKeyQSSXGDVUUVUMNB-UHFFFAOYSA-N
XLogP2.42
TPSA47.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.42
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(4-methoxy-1-methylpyrazol-5-yl)-2-methyl-2-morpholin-4-ylpropan-1-amine
CID 114656694
1-(4-methoxyphenyl)-2-methyl-2-morpholin-4-ylpropan-1-amine
CID 79051895
1-(2-methoxy-4,6-dimethylphenyl)-2-methyl-2-methylsulfonylpropan-1-amine
CID 106682260
2-N,2-N-diethyl-1-(2-methoxy-4,6-dimethylphenyl)-2-methylpropane-1,2-diamine
CID 106680712
(4-ethoxyoxan-4-yl)-(2-methoxy-4,6-dimethylphenyl)methanamine
CID 106680981
2-ethyl-1-(2-methoxy-4,6-dimethylphenyl)-2-N,2-N-dimethylbutane-1,2-diamine
CID 106680723
2-methyl-2-morpholin-4-yl-1-phenylpropan-1-amine
CID 79051741
1-(3-fluoro-4-methoxyphenyl)-3-methyl-3-morpholin-4-ylbutan-2-amine
CID 79051899
(2-methoxy-4,6-dimethylphenyl)-(4-methylthiomorpholin-3-yl)methanamine
CID 106681022
2-amino-2-(2-methoxy-4,6-dimethylphenyl)ethanol
CID 77129779
cyclobutyl-(2-methoxy-4,6-dimethylphenyl)methanamine
CID 82493927
1-(3,4-difluorophenyl)-2-methyl-2-morpholin-4-ylpropan-1-amine
CID 79051908

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxy-4,6-dimethylphenyl)-2-methyl-2-morpholin-4-ylpropan-1-amine?
The IUPAC name of 1-(2-methoxy-4,6-dimethylphenyl)-2-methyl-2-morpholin-4-ylpropan-1-amine (CID 106680717) is 1-(2-methoxy-4,6-dimethylphenyl)-2-methyl-2-morpholin-4-ylpropan-1-amine.
What is the SMILES notation for 1-(2-methoxy-4,6-dimethylphenyl)-2-methyl-2-morpholin-4-ylpropan-1-amine?
The canonical SMILES for 1-(2-methoxy-4,6-dimethylphenyl)-2-methyl-2-morpholin-4-ylpropan-1-amine is COc1cc(C)cc(C)c1C(N)C(C)(C)N1CCOCC1.
What is the InChIKey of 1-(2-methoxy-4,6-dimethylphenyl)-2-methyl-2-morpholin-4-ylpropan-1-amine?
The InChIKey is QSSXGDVUUVUMNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2O2/c1-12-10-13(2)15(14(11-12)20-5)16(18)17(3,4)19-6-8-21-9-7-19/h10-11,16H,6-9,18H2,1-5H3.
What are the key properties of 1-(2-methoxy-4,6-dimethylphenyl)-2-methyl-2-morpholin-4-ylpropan-1-amine?
1-(2-methoxy-4,6-dimethylphenyl)-2-methyl-2-morpholin-4-ylpropan-1-amine has a molecular weight of 292.42 g/mol, XLogP of 2.42, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxy-4,6-dimethylphenyl)-2-methyl-2-morpholin-4-ylpropan-1-amine is sourced from PubChem (CID 106680717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).