N-ethyl-3-methoxy-1-(2-methoxyphenyl)-4-methylpentan-2-amine

C16H27NO2 — CID 116720261

IUPACN-ethyl-3-methoxy-1-(2-methoxyphenyl)-4-methylpentan-2-amine
SMILESCCNC(Cc1ccccc1OC)C(OC)C(C)C
InChIInChI=1S/C16H27NO2/c1-6-17-14(16(19-5)12(2)3)11-13-9-7-8-10-15(13)18-4/h7-10,12,14,16-17H,6,11H2,1-5H3
InChIKeyUUUMWIHZUZFYLW-UHFFFAOYSA-N
MW265.40 g/mol
LogP2.89
Rot. Bonds8

About N-ethyl-3-methoxy-1-(2-methoxyphenyl)-4-methylpentan-2-amine

N-ethyl-3-methoxy-1-(2-methoxyphenyl)-4-methylpentan-2-amine (PubChem CID 116720261) has the molecular formula C16H27NO2 and a molecular weight of 265.40 g/mol. Its IUPAC name is N-ethyl-3-methoxy-1-(2-methoxyphenyl)-4-methylpentan-2-amine.

Molecular Properties

Compound NameN-ethyl-3-methoxy-1-(2-methoxyphenyl)-4-methylpentan-2-amine
PubChem CID116720261
Molecular FormulaC16H27NO2
Molecular Weight265.40 g/mol
Exact Mass265.20
IUPAC NameN-ethyl-3-methoxy-1-(2-methoxyphenyl)-4-methylpentan-2-amine
SMILESCCNC(Cc1ccccc1OC)C(OC)C(C)C
InChIInChI=1S/C16H27NO2/c1-6-17-14(16(19-5)12(2)3)11-13-9-7-8-10-15(13)18-4/h7-10,12,14,16-17H,6,11H2,1-5H3
InChIKeyUUUMWIHZUZFYLW-UHFFFAOYSA-N
XLogP2.89
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.40
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-ethoxy-N-ethyl-1-(2-methoxyphenyl)-4-methylpentan-2-amine
CID 116721401
N-ethyl-3-methoxy-1-(2-methoxy-5-methylphenyl)-4-methylpentan-2-amine
CID 116720374
N-ethyl-3-methoxy-1-(2-methoxyphenyl)-4,4-dimethylpentan-2-amine
CID 116724723
1-(2-bromo-3-fluorophenyl)-N-ethyl-3-methoxy-4-methylpentan-2-amine
CID 116720241
1-(1-benzothiophen-3-yl)-N-ethyl-3-methoxy-4-methylpentan-2-amine
CID 116720326
1-cyclopropyl-1-ethoxy-N-ethyl-3-(2-methoxyphenyl)propan-2-amine
CID 116723635
[1-(2-methoxyphenyl)-3,4-dimethylpentan-2-yl]hydrazine
CID 105289474
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
1-(2-ethoxyphenyl)-N-ethyl-2-methoxy-3-methylbutan-1-amine
CID 116720230
3-methoxy-4-methyl-1-phenyl-N-propylpentan-2-amine
CID 116720474
2-methoxy-1-(2-methoxyphenyl)-3-methyl-N-propylbutan-1-amine
CID 116720529

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-methoxy-1-(2-methoxyphenyl)-4-methylpentan-2-amine?
The IUPAC name of N-ethyl-3-methoxy-1-(2-methoxyphenyl)-4-methylpentan-2-amine (CID 116720261) is N-ethyl-3-methoxy-1-(2-methoxyphenyl)-4-methylpentan-2-amine.
What is the SMILES notation for N-ethyl-3-methoxy-1-(2-methoxyphenyl)-4-methylpentan-2-amine?
The canonical SMILES for N-ethyl-3-methoxy-1-(2-methoxyphenyl)-4-methylpentan-2-amine is CCNC(Cc1ccccc1OC)C(OC)C(C)C.
What is the InChIKey of N-ethyl-3-methoxy-1-(2-methoxyphenyl)-4-methylpentan-2-amine?
The InChIKey is UUUMWIHZUZFYLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27NO2/c1-6-17-14(16(19-5)12(2)3)11-13-9-7-8-10-15(13)18-4/h7-10,12,14,16-17H,6,11H2,1-5H3.
What are the key properties of N-ethyl-3-methoxy-1-(2-methoxyphenyl)-4-methylpentan-2-amine?
N-ethyl-3-methoxy-1-(2-methoxyphenyl)-4-methylpentan-2-amine has a molecular weight of 265.40 g/mol, XLogP of 2.89, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-methoxy-1-(2-methoxyphenyl)-4-methylpentan-2-amine is sourced from PubChem (CID 116720261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).