N-ethyl-3-methoxy-1-(2-methoxyphenyl)-3-methylbutan-1-amine

C15H25NO2 — CID 103024885

IUPACN-ethyl-3-methoxy-1-(2-methoxyphenyl)-3-methylbutan-1-amine
SMILESCCNC(CC(C)(C)OC)c1ccccc1OC
InChIInChI=1S/C15H25NO2/c1-6-16-13(11-15(2,3)18-5)12-9-7-8-10-14(12)17-4/h7-10,13,16H,6,11H2,1-5H3
InChIKeySZKLPWRKNXZMCP-UHFFFAOYSA-N
MW251.37 g/mol
LogP3.16
Rot. Bonds7

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

N-ethyl-3-methoxy-1-(2-methoxyphenyl)-3-methylbutan-1-amine (PubChem CID 103024885) has the molecular formula C15H25NO2 and a molecular weight of 251.37 g/mol. Its IUPAC name is N-ethyl-3-methoxy-1-(2-methoxyphenyl)-3-methylbutan-1-amine.

Molecular Properties

Compound NameN-ethyl-3-methoxy-1-(2-methoxyphenyl)-3-methylbutan-1-amine
PubChem CID103024885
Molecular FormulaC15H25NO2
Molecular Weight251.37 g/mol
Exact Mass251.19
IUPAC NameN-ethyl-3-methoxy-1-(2-methoxyphenyl)-3-methylbutan-1-amine
SMILESCCNC(CC(C)(C)OC)c1ccccc1OC
InChIInChI=1S/C15H25NO2/c1-6-16-13(11-15(2,3)18-5)12-9-7-8-10-14(12)17-4/h7-10,13,16H,6,11H2,1-5H3
InChIKeySZKLPWRKNXZMCP-UHFFFAOYSA-N
XLogP3.16
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.37
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-1-(2-methoxyphenyl)ethane-1,2-diamine
CID 62066193
N-ethyl-4,4,4-trifluoro-1-(2-methoxyphenyl)butan-1-amine
CID 64567616
1-(2,6-dimethoxyphenyl)-N-ethyl-4-methoxy-4-methylpentan-1-amine
CID 103032151
2-cyclopropyl-N-ethyl-1-(2-methoxyphenyl)ethanamine
CID 64904236
N,N',N'-triethyl-1-(2-methoxyphenyl)propane-1,3-diamine
CID 79087347
4-methoxy-N-[(1R)-1-(2-methoxyphenyl)ethyl]-4-methylpentan-2-amine
CID 81396657
2-(2,6-dichlorophenyl)-N-ethyl-1-(2-methoxyphenyl)ethanamine
CID 63414322
2-ethoxy-N-[1-(2-methoxyphenyl)propyl]-2-methylpropan-1-amine
CID 114940978
1-(2,6-dimethoxyphenyl)-3-methoxy-N,3-dimethylbutan-1-amine
CID 103029479
2-cycloheptyl-N-ethyl-1-(2-methoxyphenyl)ethanamine
CID 115793056
(1S)-1-(2-methoxyphenyl)-N-[(1S)-1-(2-methoxyphenyl)propyl]propan-1-amine
CID 102356404
N-ethyl-1-(2-methoxyphenyl)-2-(3-methoxypropylsulfonyl)ethanamine
CID 64675860

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-methoxy-1-(2-methoxyphenyl)-3-methylbutan-1-amine?
The IUPAC name of N-ethyl-3-methoxy-1-(2-methoxyphenyl)-3-methylbutan-1-amine (CID 103024885) is N-ethyl-3-methoxy-1-(2-methoxyphenyl)-3-methylbutan-1-amine.
What is the SMILES notation for N-ethyl-3-methoxy-1-(2-methoxyphenyl)-3-methylbutan-1-amine?
The canonical SMILES for N-ethyl-3-methoxy-1-(2-methoxyphenyl)-3-methylbutan-1-amine is CCNC(CC(C)(C)OC)c1ccccc1OC.
What is the InChIKey of N-ethyl-3-methoxy-1-(2-methoxyphenyl)-3-methylbutan-1-amine?
The InChIKey is SZKLPWRKNXZMCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO2/c1-6-16-13(11-15(2,3)18-5)12-9-7-8-10-14(12)17-4/h7-10,13,16H,6,11H2,1-5H3.
What are the key properties of N-ethyl-3-methoxy-1-(2-methoxyphenyl)-3-methylbutan-1-amine?
N-ethyl-3-methoxy-1-(2-methoxyphenyl)-3-methylbutan-1-amine has a molecular weight of 251.37 g/mol, XLogP of 3.16, 7 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)-3-methylbutan-1-amine is sourced from PubChem (CID 103024885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).