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

C18H29NO2 — CID 65155592

IUPACN-ethyl-2-(2-methoxyphenyl)-1-(2,4,5-trimethyloxolan-3-yl)ethanamine
SMILESCCNC(Cc1ccccc1OC)C1C(C)OC(C)C1C
InChIInChI=1S/C18H29NO2/c1-6-19-16(18-12(2)13(3)21-14(18)4)11-15-9-7-8-10-17(15)20-5/h7-10,12-14,16,18-19H,6,11H2,1-5H3
InChIKeyRUNFMUBDXRNTBK-UHFFFAOYSA-N
MW291.43 g/mol
LogP3.28
Rot. Bonds6

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

N-ethyl-2-(2-methoxyphenyl)-1-(2,4,5-trimethyloxolan-3-yl)ethanamine (PubChem CID 65155592) has the molecular formula C18H29NO2 and a molecular weight of 291.43 g/mol. Its IUPAC name is N-ethyl-2-(2-methoxyphenyl)-1-(2,4,5-trimethyloxolan-3-yl)ethanamine.

Molecular Properties

Compound NameN-ethyl-2-(2-methoxyphenyl)-1-(2,4,5-trimethyloxolan-3-yl)ethanamine
PubChem CID65155592
Molecular FormulaC18H29NO2
Molecular Weight291.43 g/mol
Exact Mass291.22
IUPAC NameN-ethyl-2-(2-methoxyphenyl)-1-(2,4,5-trimethyloxolan-3-yl)ethanamine
SMILESCCNC(Cc1ccccc1OC)C1C(C)OC(C)C1C
InChIInChI=1S/C18H29NO2/c1-6-19-16(18-12(2)13(3)21-14(18)4)11-15-9-7-8-10-17(15)20-5/h7-10,12-14,16,18-19H,6,11H2,1-5H3
InChIKeyRUNFMUBDXRNTBK-UHFFFAOYSA-N
XLogP3.28
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.43
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-cyclooctyl-N-ethyl-2-(2-methoxyphenyl)ethanamine
CID 65018291
1-(1,4-dioxan-2-yl)-N-ethyl-2-(2-methoxyphenyl)ethanamine
CID 65352738
N-ethyl-3-methoxy-1-(2-methoxyphenyl)-4-methylpentan-2-amine
CID 116720261
1-(1,4-dithian-2-yl)-N-ethyl-2-(2-methoxyphenyl)ethanamine
CID 79965549
1-(2,2-dimethylcyclopentyl)-N-ethyl-2-(2-methoxyphenyl)ethanamine
CID 107179538
N-ethyl-1-(2-methoxyphenyl)-3-phenylpropan-2-amine
CID 61263100
2-N-ethyl-4-N-[1-(2-methoxyphenyl)propan-2-yl]-4-N-methylpentane-2,4-diamine
CID 65487789
N-ethyl-3-methoxy-1-(2-methoxyphenyl)-4,4-dimethylpentan-2-amine
CID 116724723
1-cyclopropyl-N-ethyl-3-(2-methoxyphenyl)propan-1-amine
CID 63354961
N-[2-(2-methoxyphenyl)-1-(2-methyloxolan-3-yl)ethyl]propan-1-amine
CID 79758998
1-cyclopropyl-1-ethoxy-N-ethyl-3-(2-methoxyphenyl)propan-2-amine
CID 116723635
3-ethoxy-N-ethyl-1-(2-methoxyphenyl)-4-methylpentan-2-amine
CID 116721401

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(2-methoxyphenyl)-1-(2,4,5-trimethyloxolan-3-yl)ethanamine?
The IUPAC name of N-ethyl-2-(2-methoxyphenyl)-1-(2,4,5-trimethyloxolan-3-yl)ethanamine (CID 65155592) is N-ethyl-2-(2-methoxyphenyl)-1-(2,4,5-trimethyloxolan-3-yl)ethanamine.
What is the SMILES notation for N-ethyl-2-(2-methoxyphenyl)-1-(2,4,5-trimethyloxolan-3-yl)ethanamine?
The canonical SMILES for N-ethyl-2-(2-methoxyphenyl)-1-(2,4,5-trimethyloxolan-3-yl)ethanamine is CCNC(Cc1ccccc1OC)C1C(C)OC(C)C1C.
What is the InChIKey of N-ethyl-2-(2-methoxyphenyl)-1-(2,4,5-trimethyloxolan-3-yl)ethanamine?
The InChIKey is RUNFMUBDXRNTBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H29NO2/c1-6-19-16(18-12(2)13(3)21-14(18)4)11-15-9-7-8-10-17(15)20-5/h7-10,12-14,16,18-19H,6,11H2,1-5H3.
What are the key properties of N-ethyl-2-(2-methoxyphenyl)-1-(2,4,5-trimethyloxolan-3-yl)ethanamine?
N-ethyl-2-(2-methoxyphenyl)-1-(2,4,5-trimethyloxolan-3-yl)ethanamine has a molecular weight of 291.43 g/mol, XLogP of 3.28, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(2-methoxyphenyl)-1-(2,4,5-trimethyloxolan-3-yl)ethanamine is sourced from PubChem (CID 65155592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).