N-ethyl-1-(4-methoxyphenyl)-2-(3-methylphenyl)ethanamine

C18H23NO — CID 60798862

IUPACN-ethyl-1-(4-methoxyphenyl)-2-(3-methylphenyl)ethanamine
SMILESCCNC(Cc1cccc(C)c1)c1ccc(OC)cc1
InChIInChI=1S/C18H23NO/c1-4-19-18(13-15-7-5-6-14(2)12-15)16-8-10-17(20-3)11-9-16/h5-12,18-19H,4,13H2,1-3H3
InChIKeyCXQGNBMXCRYBNQ-UHFFFAOYSA-N
MW269.39 g/mol
LogP3.90
Rot. Bonds6

About N-ethyl-1-(4-methoxyphenyl)-2-(3-methylphenyl)ethanamine

N-ethyl-1-(4-methoxyphenyl)-2-(3-methylphenyl)ethanamine (PubChem CID 60798862) has the molecular formula C18H23NO and a molecular weight of 269.39 g/mol. Its IUPAC name is N-ethyl-1-(4-methoxyphenyl)-2-(3-methylphenyl)ethanamine.

Molecular Properties

Compound NameN-ethyl-1-(4-methoxyphenyl)-2-(3-methylphenyl)ethanamine
PubChem CID60798862
Molecular FormulaC18H23NO
Molecular Weight269.39 g/mol
Exact Mass269.18
IUPAC NameN-ethyl-1-(4-methoxyphenyl)-2-(3-methylphenyl)ethanamine
SMILESCCNC(Cc1cccc(C)c1)c1ccc(OC)cc1
InChIInChI=1S/C18H23NO/c1-4-19-18(13-15-7-5-6-14(2)12-15)16-8-10-17(20-3)11-9-16/h5-12,18-19H,4,13H2,1-3H3
InChIKeyCXQGNBMXCRYBNQ-UHFFFAOYSA-N
XLogP3.90
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[1-(4-methoxyphenyl)-2-(3-methylphenyl)ethyl]propan-1-amine
CID 60798724
N-ethyl-1-(3-methoxyphenyl)-2-(3-methylphenyl)ethanamine
CID 60797782
N-ethyl-1-(3-methoxy-4-methylphenyl)-2-(3-methylphenyl)ethanamine
CID 62389756
1-(3-chloro-4-methoxyphenyl)-N-ethyl-2-(3-methylphenyl)ethanamine
CID 62388356
N-ethyl-1-(4-methoxyphenyl)-2-(3-methylphenyl)sulfanylethanamine
CID 64626083
1-(2,6-dimethyl-4-pyridinyl)-N-ethyl-2-(3-methoxyphenyl)ethanamine
CID 107503839
1-(4-methoxyphenyl)-2-(3-methylphenyl)ethanol
CID 60798818
1-(3-chloro-5-methylphenyl)-N-ethyl-2-(3-methoxyphenyl)ethanamine
CID 81316183
N-[2-(3-fluorophenyl)-1-(4-methoxyphenyl)ethyl]propan-1-amine
CID 43494996
N-[1-(4-ethylphenyl)-2-(3-methylphenyl)ethyl]propan-1-amine
CID 60819207
N-ethyl-1-(5-iodothiophen-3-yl)-2-(3-methylphenyl)ethanamine
CID 79693155
1-(5-bromo-2-methoxyphenyl)-N-ethyl-2-(3-methylphenyl)ethanamine
CID 63507204

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(4-methoxyphenyl)-2-(3-methylphenyl)ethanamine?
The IUPAC name of N-ethyl-1-(4-methoxyphenyl)-2-(3-methylphenyl)ethanamine (CID 60798862) is N-ethyl-1-(4-methoxyphenyl)-2-(3-methylphenyl)ethanamine.
What is the SMILES notation for N-ethyl-1-(4-methoxyphenyl)-2-(3-methylphenyl)ethanamine?
The canonical SMILES for N-ethyl-1-(4-methoxyphenyl)-2-(3-methylphenyl)ethanamine is CCNC(Cc1cccc(C)c1)c1ccc(OC)cc1.
What is the InChIKey of N-ethyl-1-(4-methoxyphenyl)-2-(3-methylphenyl)ethanamine?
The InChIKey is CXQGNBMXCRYBNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23NO/c1-4-19-18(13-15-7-5-6-14(2)12-15)16-8-10-17(20-3)11-9-16/h5-12,18-19H,4,13H2,1-3H3.
What are the key properties of N-ethyl-1-(4-methoxyphenyl)-2-(3-methylphenyl)ethanamine?
N-ethyl-1-(4-methoxyphenyl)-2-(3-methylphenyl)ethanamine has a molecular weight of 269.39 g/mol, XLogP of 3.90, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(4-methoxyphenyl)-2-(3-methylphenyl)ethanamine is sourced from PubChem (CID 60798862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).