N-ethyl-2-methyl-2-(2,4,5-trimethoxyphenyl)propan-1-amine

C15H25NO3 — CID 115005597

IUPACN-ethyl-2-methyl-2-(2,4,5-trimethoxyphenyl)propan-1-amine
SMILESCCNCC(C)(C)c1cc(OC)c(OC)cc1OC
InChIInChI=1S/C15H25NO3/c1-7-16-10-15(2,3)11-8-13(18-5)14(19-6)9-12(11)17-4/h8-9,16H,7,10H2,1-6H3
InChIKeyUSFLURXIPSQEJY-UHFFFAOYSA-N
MW267.37 g/mol
LogP2.60
Rot. Bonds7

About N-ethyl-2-methyl-2-(2,4,5-trimethoxyphenyl)propan-1-amine

N-ethyl-2-methyl-2-(2,4,5-trimethoxyphenyl)propan-1-amine (PubChem CID 115005597) has the molecular formula C15H25NO3 and a molecular weight of 267.37 g/mol. Its IUPAC name is N-ethyl-2-methyl-2-(2,4,5-trimethoxyphenyl)propan-1-amine.

Molecular Properties

Compound NameN-ethyl-2-methyl-2-(2,4,5-trimethoxyphenyl)propan-1-amine
PubChem CID115005597
Molecular FormulaC15H25NO3
Molecular Weight267.37 g/mol
Exact Mass267.18
IUPAC NameN-ethyl-2-methyl-2-(2,4,5-trimethoxyphenyl)propan-1-amine
SMILESCCNCC(C)(C)c1cc(OC)c(OC)cc1OC
InChIInChI=1S/C15H25NO3/c1-7-16-10-15(2,3)11-8-13(18-5)14(19-6)9-12(11)17-4/h8-9,16H,7,10H2,1-6H3
InChIKeyUSFLURXIPSQEJY-UHFFFAOYSA-N
XLogP2.60
TPSA39.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-ethyl-2-(5-ethyl-2-methoxyphenyl)-2-methylpropan-1-amine
CID 112518134
2-(2,4-dimethoxyphenyl)-1-(ethylamino)propan-2-ol
CID 62774366
N-methyl-2-(2,4,5-trimethoxyphenyl)propan-2-amine
CID 96840579
2-(2,4,5-trimethoxyphenyl)propan-2-amine
CID 15102791
N-(bromomethyl)-2-(2-methoxy-5-methylphenyl)-2-methylpropan-1-amine
CID 115262514
2-methyl-2-(2,4,5-trimethoxyphenyl)butan-1-amine
CID 112518955
3-(2,4-dimethoxyphenyl)-N-ethyl-3-methylbutan-1-amine
CID 81023243
N-ethyl-N'-[2-methyl-2-(2,4,5-trimethylphenyl)propyl]ethane-1,2-diamine
CID 115206175
[2-(2,5-dimethoxy-4-methylphenyl)-2-methylpropyl]urea
CID 115168800
N-(bromomethyl)-2-(4-methoxy-2,5-dimethylphenyl)-2-methylpropan-1-amine
CID 115262540
N-(bromomethyl)-2-(2-methoxy-4-propan-2-ylphenyl)-2-methylpropan-1-amine
CID 115262570
2-[[2-(5-bromo-2-methoxyphenyl)-2-methylpropyl]amino]ethanol
CID 115216511

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-methyl-2-(2,4,5-trimethoxyphenyl)propan-1-amine?
The IUPAC name of N-ethyl-2-methyl-2-(2,4,5-trimethoxyphenyl)propan-1-amine (CID 115005597) is N-ethyl-2-methyl-2-(2,4,5-trimethoxyphenyl)propan-1-amine.
What is the SMILES notation for N-ethyl-2-methyl-2-(2,4,5-trimethoxyphenyl)propan-1-amine?
The canonical SMILES for N-ethyl-2-methyl-2-(2,4,5-trimethoxyphenyl)propan-1-amine is CCNCC(C)(C)c1cc(OC)c(OC)cc1OC.
What is the InChIKey of N-ethyl-2-methyl-2-(2,4,5-trimethoxyphenyl)propan-1-amine?
The InChIKey is USFLURXIPSQEJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO3/c1-7-16-10-15(2,3)11-8-13(18-5)14(19-6)9-12(11)17-4/h8-9,16H,7,10H2,1-6H3.
What are the key properties of N-ethyl-2-methyl-2-(2,4,5-trimethoxyphenyl)propan-1-amine?
N-ethyl-2-methyl-2-(2,4,5-trimethoxyphenyl)propan-1-amine has a molecular weight of 267.37 g/mol, XLogP of 2.60, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-methyl-2-(2,4,5-trimethoxyphenyl)propan-1-amine is sourced from PubChem (CID 115005597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).