3-(3-ethylmorpholin-4-yl)-2-methyl-1-phenylpropan-1-amine

C16H26N2O — CID 62618747

IUPAC3-(3-ethylmorpholin-4-yl)-2-methyl-1-phenylpropan-1-amine
SMILESCCC1COCCN1CC(C)C(N)c1ccccc1
InChIInChI=1S/C16H26N2O/c1-3-15-12-19-10-9-18(15)11-13(2)16(17)14-7-5-4-6-8-14/h4-8,13,15-16H,3,9-12,17H2,1-2H3
InChIKeyKADHRLCMTAIDLZ-UHFFFAOYSA-N
MW262.40 g/mol
LogP2.43
Rot. Bonds5

About 3-(3-ethylmorpholin-4-yl)-2-methyl-1-phenylpropan-1-amine

3-(3-ethylmorpholin-4-yl)-2-methyl-1-phenylpropan-1-amine (PubChem CID 62618747) has the molecular formula C16H26N2O and a molecular weight of 262.40 g/mol. Its IUPAC name is 3-(3-ethylmorpholin-4-yl)-2-methyl-1-phenylpropan-1-amine.

Molecular Properties

Compound Name3-(3-ethylmorpholin-4-yl)-2-methyl-1-phenylpropan-1-amine
PubChem CID62618747
Molecular FormulaC16H26N2O
Molecular Weight262.40 g/mol
Exact Mass262.20
IUPAC Name3-(3-ethylmorpholin-4-yl)-2-methyl-1-phenylpropan-1-amine
SMILESCCC1COCCN1CC(C)C(N)c1ccccc1
InChIInChI=1S/C16H26N2O/c1-3-15-12-19-10-9-18(15)11-13(2)16(17)14-7-5-4-6-8-14/h4-8,13,15-16H,3,9-12,17H2,1-2H3
InChIKeyKADHRLCMTAIDLZ-UHFFFAOYSA-N
XLogP2.43
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-ethylmorpholin-4-yl)-1-phenylethanamine
CID 43613110
2-methyl-3-(3-methylmorpholin-4-yl)-1-phenylpropan-1-amine
CID 62619774
1-(3-ethylmorpholin-4-yl)-1-phenylpropan-2-amine
CID 55017138
2-(3-ethylmorpholin-4-yl)-3-methyl-1-phenylbutan-1-amine
CID 43613063
2-(3-ethylmorpholin-4-yl)-1-(4-propan-2-ylphenyl)ethanamine
CID 43613076
(3S)-4-benzyl-3-ethylmorpholine
CID 54501252
1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(3-ethylmorpholin-4-yl)ethanamine
CID 43613115
1-(3-ethylmorpholin-4-yl)-1-(3-methylphenyl)propan-2-amine
CID 55020122
4-(3-bromo-2-methylpropyl)-3-ethylmorpholine
CID 64996341
1-(3-ethylmorpholin-4-yl)-3-methoxypropan-2-amine
CID 81101741
4-[2-(azetidin-3-yl)propyl]-3-ethylmorpholine
CID 116679461
3-(2-cyclopentylpyrrolidin-1-yl)-2-methyl-1-phenylpropan-1-amine
CID 62617910

Frequently Asked Questions

What is the IUPAC name of 3-(3-ethylmorpholin-4-yl)-2-methyl-1-phenylpropan-1-amine?
The IUPAC name of 3-(3-ethylmorpholin-4-yl)-2-methyl-1-phenylpropan-1-amine (CID 62618747) is 3-(3-ethylmorpholin-4-yl)-2-methyl-1-phenylpropan-1-amine.
What is the SMILES notation for 3-(3-ethylmorpholin-4-yl)-2-methyl-1-phenylpropan-1-amine?
The canonical SMILES for 3-(3-ethylmorpholin-4-yl)-2-methyl-1-phenylpropan-1-amine is CCC1COCCN1CC(C)C(N)c1ccccc1.
What is the InChIKey of 3-(3-ethylmorpholin-4-yl)-2-methyl-1-phenylpropan-1-amine?
The InChIKey is KADHRLCMTAIDLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O/c1-3-15-12-19-10-9-18(15)11-13(2)16(17)14-7-5-4-6-8-14/h4-8,13,15-16H,3,9-12,17H2,1-2H3.
What are the key properties of 3-(3-ethylmorpholin-4-yl)-2-methyl-1-phenylpropan-1-amine?
3-(3-ethylmorpholin-4-yl)-2-methyl-1-phenylpropan-1-amine has a molecular weight of 262.40 g/mol, XLogP of 2.43, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-ethylmorpholin-4-yl)-2-methyl-1-phenylpropan-1-amine is sourced from PubChem (CID 62618747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).