2-(3,5-dichlorophenyl)-2-(2,2,6,6-tetramethylmorpholin-4-yl)ethanamine

C16H24Cl2N2O — CID 102743193

IUPAC2-(3,5-dichlorophenyl)-2-(2,2,6,6-tetramethylmorpholin-4-yl)ethanamine
SMILESCC1(C)CN(C(CN)c2cc(Cl)cc(Cl)c2)CC(C)(C)O1
InChIInChI=1S/C16H24Cl2N2O/c1-15(2)9-20(10-16(3,4)21-15)14(8-19)11-5-12(17)7-13(18)6-11/h5-7,14H,8-10,19H2,1-4H3
InChIKeyPUWYSBDQYLOUFY-UHFFFAOYSA-N
MW331.29 g/mol
LogP3.88
Rot. Bonds3

About 2-(3,5-dichlorophenyl)-2-(2,2,6,6-tetramethylmorpholin-4-yl)ethanamine

2-(3,5-dichlorophenyl)-2-(2,2,6,6-tetramethylmorpholin-4-yl)ethanamine (PubChem CID 102743193) has the molecular formula C16H24Cl2N2O and a molecular weight of 331.29 g/mol. Its IUPAC name is 2-(3,5-dichlorophenyl)-2-(2,2,6,6-tetramethylmorpholin-4-yl)ethanamine.

Molecular Properties

Compound Name2-(3,5-dichlorophenyl)-2-(2,2,6,6-tetramethylmorpholin-4-yl)ethanamine
PubChem CID102743193
Molecular FormulaC16H24Cl2N2O
Molecular Weight331.29 g/mol
Exact Mass330.13
IUPAC Name2-(3,5-dichlorophenyl)-2-(2,2,6,6-tetramethylmorpholin-4-yl)ethanamine
SMILESCC1(C)CN(C(CN)c2cc(Cl)cc(Cl)c2)CC(C)(C)O1
InChIInChI=1S/C16H24Cl2N2O/c1-15(2)9-20(10-16(3,4)21-15)14(8-19)11-5-12(17)7-13(18)6-11/h5-7,14H,8-10,19H2,1-4H3
InChIKeyPUWYSBDQYLOUFY-UHFFFAOYSA-N
XLogP3.88
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.29
LogP ≤ 53.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-bromo-5-chlorothiophen-2-yl)-2-(2,2,6,6-tetramethylmorpholin-4-yl)ethanamine
CID 102840074
(2S)-2-(3,5-dichlorophenyl)-2-[(2R,6R)-2,6-dimethylmorpholin-4-yl]ethanamine
CID 124552555
2-(3-methoxyphenyl)-2-(2,2,6,6-tetramethylmorpholin-4-yl)ethanamine
CID 102742931
2-(azepan-1-yl)-2-(3,5-dichlorophenyl)ethanamine
CID 60788814
2-(2-fluorophenyl)-2-(2,2,6,6-tetramethylmorpholin-4-yl)ethanamine
CID 102742921
2-(5-methylfuran-2-yl)-2-(2,2,6,6-tetramethylmorpholin-4-yl)ethanamine
CID 102742936
2-(3,5-dichlorophenyl)-2-(2,2-dimethylpyrrolidin-1-yl)ethanamine
CID 63216072
(2S)-2-(3,5-dichlorophenyl)-2-[(3S)-3-methylpiperidin-1-yl]ethanamine
CID 124552547
2-(3,5-dichlorophenyl)-2-(3,4-dimethylpiperazin-1-yl)ethanamine
CID 63605245
1-[2-amino-1-(3,5-dichlorophenyl)ethyl]-N,N,4-trimethylpyrrolidin-3-amine
CID 81465043
2-(3-chloro-4-methylphenyl)-2-(2,2,6-trimethylmorpholin-4-yl)ethanamine
CID 106817369
2-(3-chloro-5-fluorophenyl)-2-(3,5-dimethylpiperidin-1-yl)ethanamine
CID 114453224

Frequently Asked Questions

What is the IUPAC name of 2-(3,5-dichlorophenyl)-2-(2,2,6,6-tetramethylmorpholin-4-yl)ethanamine?
The IUPAC name of 2-(3,5-dichlorophenyl)-2-(2,2,6,6-tetramethylmorpholin-4-yl)ethanamine (CID 102743193) is 2-(3,5-dichlorophenyl)-2-(2,2,6,6-tetramethylmorpholin-4-yl)ethanamine.
What is the SMILES notation for 2-(3,5-dichlorophenyl)-2-(2,2,6,6-tetramethylmorpholin-4-yl)ethanamine?
The canonical SMILES for 2-(3,5-dichlorophenyl)-2-(2,2,6,6-tetramethylmorpholin-4-yl)ethanamine is CC1(C)CN(C(CN)c2cc(Cl)cc(Cl)c2)CC(C)(C)O1.
What is the InChIKey of 2-(3,5-dichlorophenyl)-2-(2,2,6,6-tetramethylmorpholin-4-yl)ethanamine?
The InChIKey is PUWYSBDQYLOUFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24Cl2N2O/c1-15(2)9-20(10-16(3,4)21-15)14(8-19)11-5-12(17)7-13(18)6-11/h5-7,14H,8-10,19H2,1-4H3.
What are the key properties of 2-(3,5-dichlorophenyl)-2-(2,2,6,6-tetramethylmorpholin-4-yl)ethanamine?
2-(3,5-dichlorophenyl)-2-(2,2,6,6-tetramethylmorpholin-4-yl)ethanamine has a molecular weight of 331.29 g/mol, XLogP of 3.88, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-dichlorophenyl)-2-(2,2,6,6-tetramethylmorpholin-4-yl)ethanamine is sourced from PubChem (CID 102743193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).