1-(3-ethylmorpholin-4-yl)-1-(3-methylphenyl)propan-2-amine

C16H26N2O — CID 55020122

IUPAC1-(3-ethylmorpholin-4-yl)-1-(3-methylphenyl)propan-2-amine
SMILESCCC1COCCN1C(c1cccc(C)c1)C(C)N
InChIInChI=1S/C16H26N2O/c1-4-15-11-19-9-8-18(15)16(13(3)17)14-7-5-6-12(2)10-14/h5-7,10,13,15-16H,4,8-9,11,17H2,1-3H3
InChIKeyNRAPUTCLUDUVOP-UHFFFAOYSA-N
MW262.40 g/mol
LogP2.49
Rot. Bonds4

About 1-(3-ethylmorpholin-4-yl)-1-(3-methylphenyl)propan-2-amine

1-(3-ethylmorpholin-4-yl)-1-(3-methylphenyl)propan-2-amine (PubChem CID 55020122) has the molecular formula C16H26N2O and a molecular weight of 262.40 g/mol. Its IUPAC name is 1-(3-ethylmorpholin-4-yl)-1-(3-methylphenyl)propan-2-amine.

Molecular Properties

Compound Name1-(3-ethylmorpholin-4-yl)-1-(3-methylphenyl)propan-2-amine
PubChem CID55020122
Molecular FormulaC16H26N2O
Molecular Weight262.40 g/mol
Exact Mass262.20
IUPAC Name1-(3-ethylmorpholin-4-yl)-1-(3-methylphenyl)propan-2-amine
SMILESCCC1COCCN1C(c1cccc(C)c1)C(C)N
InChIInChI=1S/C16H26N2O/c1-4-15-11-19-9-8-18(15)16(13(3)17)14-7-5-6-12(2)10-14/h5-7,10,13,15-16H,4,8-9,11,17H2,1-3H3
InChIKeyNRAPUTCLUDUVOP-UHFFFAOYSA-N
XLogP2.49
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3-ethylmorpholin-4-yl)-1-phenylpropan-2-amine
CID 55017138
1-(3-ethylmorpholin-4-yl)-1-thiophen-2-ylpropan-2-amine
CID 55021955
1-(3-methylphenyl)-1-(2-propylpiperidin-1-yl)propan-2-amine
CID 83053735
2-(3-ethylmorpholin-4-yl)-3-methyl-1-phenylbutan-1-amine
CID 43613063
1-(2-azabicyclo[2.2.1]heptan-2-yl)-1-(3-methylphenyl)propan-2-amine
CID 55020075
3-(3-ethylmorpholin-4-yl)-2-methyl-1-phenylpropan-1-amine
CID 62618747
1-(3-chlorophenyl)-1-(2-ethylpiperidin-1-yl)propan-2-amine
CID 55019306
2-(3-ethylmorpholin-4-yl)-1-phenylethanamine
CID 43613110
2-(3-ethylmorpholin-4-yl)-2-pyridin-3-ylethanamine
CID 43612945
3-(3-ethylmorpholin-4-yl)-N'-hydroxy-3-phenylpropanimidamide
CID 76949126
2-(3-ethylmorpholin-4-yl)-2-naphthalen-2-ylethanamine
CID 43611864
1-(3,4-dimethylpyrrolidin-1-yl)-1-(3-methylphenyl)propan-2-amine
CID 79188749

Frequently Asked Questions

What is the IUPAC name of 1-(3-ethylmorpholin-4-yl)-1-(3-methylphenyl)propan-2-amine?
The IUPAC name of 1-(3-ethylmorpholin-4-yl)-1-(3-methylphenyl)propan-2-amine (CID 55020122) is 1-(3-ethylmorpholin-4-yl)-1-(3-methylphenyl)propan-2-amine.
What is the SMILES notation for 1-(3-ethylmorpholin-4-yl)-1-(3-methylphenyl)propan-2-amine?
The canonical SMILES for 1-(3-ethylmorpholin-4-yl)-1-(3-methylphenyl)propan-2-amine is CCC1COCCN1C(c1cccc(C)c1)C(C)N.
What is the InChIKey of 1-(3-ethylmorpholin-4-yl)-1-(3-methylphenyl)propan-2-amine?
The InChIKey is NRAPUTCLUDUVOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O/c1-4-15-11-19-9-8-18(15)16(13(3)17)14-7-5-6-12(2)10-14/h5-7,10,13,15-16H,4,8-9,11,17H2,1-3H3.
What are the key properties of 1-(3-ethylmorpholin-4-yl)-1-(3-methylphenyl)propan-2-amine?
1-(3-ethylmorpholin-4-yl)-1-(3-methylphenyl)propan-2-amine has a molecular weight of 262.40 g/mol, XLogP of 2.49, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-ethylmorpholin-4-yl)-1-(3-methylphenyl)propan-2-amine is sourced from PubChem (CID 55020122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).