2-(2-chlorophenyl)-N-ethyl-1-(2,4,5-trimethyloxolan-3-yl)ethanamine

C17H26ClNO — CID 65155941

IUPAC2-(2-chlorophenyl)-N-ethyl-1-(2,4,5-trimethyloxolan-3-yl)ethanamine
SMILESCCNC(Cc1ccccc1Cl)C1C(C)OC(C)C1C
InChIInChI=1S/C17H26ClNO/c1-5-19-16(10-14-8-6-7-9-15(14)18)17-11(2)12(3)20-13(17)4/h6-9,11-13,16-17,19H,5,10H2,1-4H3
InChIKeyLZTPDILPWWIOKD-UHFFFAOYSA-N
MW295.85 g/mol
LogP3.92
Rot. Bonds5

About 2-(2-chlorophenyl)-N-ethyl-1-(2,4,5-trimethyloxolan-3-yl)ethanamine

2-(2-chlorophenyl)-N-ethyl-1-(2,4,5-trimethyloxolan-3-yl)ethanamine (PubChem CID 65155941) has the molecular formula C17H26ClNO and a molecular weight of 295.85 g/mol. Its IUPAC name is 2-(2-chlorophenyl)-N-ethyl-1-(2,4,5-trimethyloxolan-3-yl)ethanamine.

Molecular Properties

Compound Name2-(2-chlorophenyl)-N-ethyl-1-(2,4,5-trimethyloxolan-3-yl)ethanamine
PubChem CID65155941
Molecular FormulaC17H26ClNO
Molecular Weight295.85 g/mol
Exact Mass295.17
IUPAC Name2-(2-chlorophenyl)-N-ethyl-1-(2,4,5-trimethyloxolan-3-yl)ethanamine
SMILESCCNC(Cc1ccccc1Cl)C1C(C)OC(C)C1C
InChIInChI=1S/C17H26ClNO/c1-5-19-16(10-14-8-6-7-9-15(14)18)17-11(2)12(3)20-13(17)4/h6-9,11-13,16-17,19H,5,10H2,1-4H3
InChIKeyLZTPDILPWWIOKD-UHFFFAOYSA-N
XLogP3.92
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.85
LogP ≤ 53.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-2-(2-methoxyphenyl)-1-(2,4,5-trimethyloxolan-3-yl)ethanamine
CID 65155592
2-(2-chlorophenyl)-N-ethyl-1-(2-methyloxolan-3-yl)ethanamine
CID 79759747
2-(2,5-dichlorophenyl)-N-methyl-1-(2,4,5-trimethyloxolan-3-yl)ethanamine
CID 115862951
1-(2-chlorophenyl)-N-ethylpropan-2-amine
CID 43677539
[2-(2-bromophenyl)-1-(2,4,5-trimethyloxolan-3-yl)ethyl]hydrazine
CID 105283970
[2-phenyl-1-(2,4,5-trimethyloxolan-3-yl)ethyl]hydrazine
CID 105283188
1-(2-chlorophenyl)-N-ethyl-4-phenylbutan-2-amine
CID 63417051
1-(2-chlorophenyl)-N-methyl-1-(2,4,5-trimethyloxolan-3-yl)methanamine
CID 115800984
1-(2-chlorophenyl)-N-ethyl-4,4,4-trifluoro-3-(trifluoromethyl)butan-2-amine
CID 103311717
2-(2-chlorophenyl)-1-(1,4-dithian-2-yl)-N-ethylethanamine
CID 79965548
3-[(2-chlorophenyl)methyl]-N-ethyl-4-methylpentan-2-amine
CID 62914731
2-(2-chlorophenyl)-1-(2,3-dichlorophenyl)-N-ethylethanamine
CID 63415143

Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenyl)-N-ethyl-1-(2,4,5-trimethyloxolan-3-yl)ethanamine?
The IUPAC name of 2-(2-chlorophenyl)-N-ethyl-1-(2,4,5-trimethyloxolan-3-yl)ethanamine (CID 65155941) is 2-(2-chlorophenyl)-N-ethyl-1-(2,4,5-trimethyloxolan-3-yl)ethanamine.
What is the SMILES notation for 2-(2-chlorophenyl)-N-ethyl-1-(2,4,5-trimethyloxolan-3-yl)ethanamine?
The canonical SMILES for 2-(2-chlorophenyl)-N-ethyl-1-(2,4,5-trimethyloxolan-3-yl)ethanamine is CCNC(Cc1ccccc1Cl)C1C(C)OC(C)C1C.
What is the InChIKey of 2-(2-chlorophenyl)-N-ethyl-1-(2,4,5-trimethyloxolan-3-yl)ethanamine?
The InChIKey is LZTPDILPWWIOKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26ClNO/c1-5-19-16(10-14-8-6-7-9-15(14)18)17-11(2)12(3)20-13(17)4/h6-9,11-13,16-17,19H,5,10H2,1-4H3.
What are the key properties of 2-(2-chlorophenyl)-N-ethyl-1-(2,4,5-trimethyloxolan-3-yl)ethanamine?
2-(2-chlorophenyl)-N-ethyl-1-(2,4,5-trimethyloxolan-3-yl)ethanamine has a molecular weight of 295.85 g/mol, XLogP of 3.92, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenyl)-N-ethyl-1-(2,4,5-trimethyloxolan-3-yl)ethanamine is sourced from PubChem (CID 65155941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).